data_27744 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27744 _Entry.Title ; Backbone chemical shift assignments of translation initiation factor 3 from Pseudomonas aeruginosa ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-12-26 _Entry.Accession_date 2018-12-26 _Entry.Last_release_date 2019-01-02 _Entry.Original_release_date 2019-01-02 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Yonghong Zhang . . . . 27744 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27744 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 677 27744 '15N chemical shifts' 171 27744 '1H chemical shifts' 1145 27744 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2020-04-07 2018-12-26 update BMRB 'update entry citation' 27744 1 . . 2020-02-28 2018-12-26 original author 'original release' 27744 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27744 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 31902070 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Backbone chemical shift assignments of translation initiation factor 3 from Pseudomonas aeruginosa ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 14 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 93 _Citation.Page_last 97 _Citation.Year 2020 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Libo Li L. . . . 27744 1 2 Stephanie Palmer S. O. . . 27744 1 3 Elizabeth Gomez E. A. . . 27744 1 4 Frank Mendiola F. . . . 27744 1 5 Tianzhi Wang T. . . . 27744 1 6 James Bullard J. M. . . 27744 1 7 Yonghong Zhang Y. . . . 27744 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27744 _Assembly.ID 1 _Assembly.Name PaIF3 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 PaIF3 1 $PaIF3 A . yes native no no . . . 27744 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PaIF3 _Entity.Sf_category entity _Entity.Sf_framecode PaIF3 _Entity.Entry_ID 27744 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PaIF3 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MASIIKREMRQDKRAQPKPP INENISAREVRLIGADGQQV GVVSIDEAIRLAEEAKLDLV EISADAVPPVCRIMDYGKHL FEKKKQAAVAKKNQKQAQVK EIKFRPGTEEGDYQVKLRNL VRFLSEGDKAKVSLRFRGRE MAHQELGMELLKRVEADLVE YGTVEQHPKLEGRQLMMVIA PKKKKLEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; The first three residues (MAS) are from cloning artifacts. The last 8 residues (LEHHHHHH) represent a non-native affinity tag. This is a bacterial ribosome binding protein from Pseudomonas aeruginosa. ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 193 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -2 MET . 27744 1 2 -1 ALA . 27744 1 3 0 SER . 27744 1 4 1 ILE . 27744 1 5 2 ILE . 27744 1 6 3 LYS . 27744 1 7 4 ARG . 27744 1 8 5 GLU . 27744 1 9 6 MET . 27744 1 10 7 ARG . 27744 1 11 8 GLN . 27744 1 12 9 ASP . 27744 1 13 10 LYS . 27744 1 14 11 ARG . 27744 1 15 12 ALA . 27744 1 16 13 GLN . 27744 1 17 14 PRO . 27744 1 18 15 LYS . 27744 1 19 16 PRO . 27744 1 20 17 PRO . 27744 1 21 18 ILE . 27744 1 22 19 ASN . 27744 1 23 20 GLU . 27744 1 24 21 ASN . 27744 1 25 22 ILE . 27744 1 26 23 SER . 27744 1 27 24 ALA . 27744 1 28 25 ARG . 27744 1 29 26 GLU . 27744 1 30 27 VAL . 27744 1 31 28 ARG . 27744 1 32 29 LEU . 27744 1 33 30 ILE . 27744 1 34 31 GLY . 27744 1 35 32 ALA . 27744 1 36 33 ASP . 27744 1 37 34 GLY . 27744 1 38 35 GLN . 27744 1 39 36 GLN . 27744 1 40 37 VAL . 27744 1 41 38 GLY . 27744 1 42 39 VAL . 27744 1 43 40 VAL . 27744 1 44 41 SER . 27744 1 45 42 ILE . 27744 1 46 43 ASP . 27744 1 47 44 GLU . 27744 1 48 45 ALA . 27744 1 49 46 ILE . 27744 1 50 47 ARG . 27744 1 51 48 LEU . 27744 1 52 49 ALA . 27744 1 53 50 GLU . 27744 1 54 51 GLU . 27744 1 55 52 ALA . 27744 1 56 53 LYS . 27744 1 57 54 LEU . 27744 1 58 55 ASP . 27744 1 59 56 LEU . 27744 1 60 57 VAL . 27744 1 61 58 GLU . 27744 1 62 59 ILE . 27744 1 63 60 SER . 27744 1 64 61 ALA . 27744 1 65 62 ASP . 27744 1 66 63 ALA . 27744 1 67 64 VAL . 27744 1 68 65 PRO . 27744 1 69 66 PRO . 27744 1 70 67 VAL . 27744 1 71 68 CYS . 27744 1 72 69 ARG . 27744 1 73 70 ILE . 27744 1 74 71 MET . 27744 1 75 72 ASP . 27744 1 76 73 TYR . 27744 1 77 74 GLY . 27744 1 78 75 LYS . 27744 1 79 76 HIS . 27744 1 80 77 LEU . 27744 1 81 78 PHE . 27744 1 82 79 GLU . 27744 1 83 80 LYS . 27744 1 84 81 LYS . 27744 1 85 82 LYS . 27744 1 86 83 GLN . 27744 1 87 84 ALA . 27744 1 88 85 ALA . 27744 1 89 86 VAL . 27744 1 90 87 ALA . 27744 1 91 88 LYS . 27744 1 92 89 LYS . 27744 1 93 90 ASN . 27744 1 94 91 GLN . 27744 1 95 92 LYS . 27744 1 96 93 GLN . 27744 1 97 94 ALA . 27744 1 98 95 GLN . 27744 1 99 96 VAL . 27744 1 100 97 LYS . 27744 1 101 98 GLU . 27744 1 102 99 ILE . 27744 1 103 100 LYS . 27744 1 104 101 PHE . 27744 1 105 102 ARG . 27744 1 106 103 PRO . 27744 1 107 104 GLY . 27744 1 108 105 THR . 27744 1 109 106 GLU . 27744 1 110 107 GLU . 27744 1 111 108 GLY . 27744 1 112 109 ASP . 27744 1 113 110 TYR . 27744 1 114 111 GLN . 27744 1 115 112 VAL . 27744 1 116 113 LYS . 27744 1 117 114 LEU . 27744 1 118 115 ARG . 27744 1 119 116 ASN . 27744 1 120 117 LEU . 27744 1 121 118 VAL . 27744 1 122 119 ARG . 27744 1 123 120 PHE . 27744 1 124 121 LEU . 27744 1 125 122 SER . 27744 1 126 123 GLU . 27744 1 127 124 GLY . 27744 1 128 125 ASP . 27744 1 129 126 LYS . 27744 1 130 127 ALA . 27744 1 131 128 LYS . 27744 1 132 129 VAL . 27744 1 133 130 SER . 27744 1 134 131 LEU . 27744 1 135 132 ARG . 27744 1 136 133 PHE . 27744 1 137 134 ARG . 27744 1 138 135 GLY . 27744 1 139 136 ARG . 27744 1 140 137 GLU . 27744 1 141 138 MET . 27744 1 142 139 ALA . 27744 1 143 140 HIS . 27744 1 144 141 GLN . 27744 1 145 142 GLU . 27744 1 146 143 LEU . 27744 1 147 144 GLY . 27744 1 148 145 MET . 27744 1 149 146 GLU . 27744 1 150 147 LEU . 27744 1 151 148 LEU . 27744 1 152 149 LYS . 27744 1 153 150 ARG . 27744 1 154 151 VAL . 27744 1 155 152 GLU . 27744 1 156 153 ALA . 27744 1 157 154 ASP . 27744 1 158 155 LEU . 27744 1 159 156 VAL . 27744 1 160 157 GLU . 27744 1 161 158 TYR . 27744 1 162 159 GLY . 27744 1 163 160 THR . 27744 1 164 161 VAL . 27744 1 165 162 GLU . 27744 1 166 163 GLN . 27744 1 167 164 HIS . 27744 1 168 165 PRO . 27744 1 169 166 LYS . 27744 1 170 167 LEU . 27744 1 171 168 GLU . 27744 1 172 169 GLY . 27744 1 173 170 ARG . 27744 1 174 171 GLN . 27744 1 175 172 LEU . 27744 1 176 173 MET . 27744 1 177 174 MET . 27744 1 178 175 VAL . 27744 1 179 176 ILE . 27744 1 180 177 ALA . 27744 1 181 178 PRO . 27744 1 182 179 LYS . 27744 1 183 180 LYS . 27744 1 184 181 LYS . 27744 1 185 182 LYS . 27744 1 186 183 LEU . 27744 1 187 184 GLU . 27744 1 188 185 HIS . 27744 1 189 186 HIS . 27744 1 190 187 HIS . 27744 1 191 188 HIS . 27744 1 192 189 HIS . 27744 1 193 190 HIS . 27744 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 27744 1 . ALA 2 2 27744 1 . SER 3 3 27744 1 . ILE 4 4 27744 1 . ILE 5 5 27744 1 . LYS 6 6 27744 1 . ARG 7 7 27744 1 . GLU 8 8 27744 1 . MET 9 9 27744 1 . ARG 10 10 27744 1 . GLN 11 11 27744 1 . ASP 12 12 27744 1 . LYS 13 13 27744 1 . ARG 14 14 27744 1 . ALA 15 15 27744 1 . GLN 16 16 27744 1 . PRO 17 17 27744 1 . LYS 18 18 27744 1 . PRO 19 19 27744 1 . PRO 20 20 27744 1 . ILE 21 21 27744 1 . ASN 22 22 27744 1 . GLU 23 23 27744 1 . ASN 24 24 27744 1 . ILE 25 25 27744 1 . SER 26 26 27744 1 . ALA 27 27 27744 1 . ARG 28 28 27744 1 . GLU 29 29 27744 1 . VAL 30 30 27744 1 . ARG 31 31 27744 1 . LEU 32 32 27744 1 . ILE 33 33 27744 1 . GLY 34 34 27744 1 . ALA 35 35 27744 1 . ASP 36 36 27744 1 . GLY 37 37 27744 1 . GLN 38 38 27744 1 . GLN 39 39 27744 1 . VAL 40 40 27744 1 . GLY 41 41 27744 1 . VAL 42 42 27744 1 . VAL 43 43 27744 1 . SER 44 44 27744 1 . ILE 45 45 27744 1 . ASP 46 46 27744 1 . GLU 47 47 27744 1 . ALA 48 48 27744 1 . ILE 49 49 27744 1 . ARG 50 50 27744 1 . LEU 51 51 27744 1 . ALA 52 52 27744 1 . GLU 53 53 27744 1 . GLU 54 54 27744 1 . ALA 55 55 27744 1 . LYS 56 56 27744 1 . LEU 57 57 27744 1 . ASP 58 58 27744 1 . LEU 59 59 27744 1 . VAL 60 60 27744 1 . GLU 61 61 27744 1 . ILE 62 62 27744 1 . SER 63 63 27744 1 . ALA 64 64 27744 1 . ASP 65 65 27744 1 . ALA 66 66 27744 1 . VAL 67 67 27744 1 . PRO 68 68 27744 1 . PRO 69 69 27744 1 . VAL 70 70 27744 1 . CYS 71 71 27744 1 . ARG 72 72 27744 1 . ILE 73 73 27744 1 . MET 74 74 27744 1 . ASP 75 75 27744 1 . TYR 76 76 27744 1 . GLY 77 77 27744 1 . LYS 78 78 27744 1 . HIS 79 79 27744 1 . LEU 80 80 27744 1 . PHE 81 81 27744 1 . GLU 82 82 27744 1 . LYS 83 83 27744 1 . LYS 84 84 27744 1 . LYS 85 85 27744 1 . GLN 86 86 27744 1 . ALA 87 87 27744 1 . ALA 88 88 27744 1 . VAL 89 89 27744 1 . ALA 90 90 27744 1 . LYS 91 91 27744 1 . LYS 92 92 27744 1 . ASN 93 93 27744 1 . GLN 94 94 27744 1 . LYS 95 95 27744 1 . GLN 96 96 27744 1 . ALA 97 97 27744 1 . GLN 98 98 27744 1 . VAL 99 99 27744 1 . LYS 100 100 27744 1 . GLU 101 101 27744 1 . ILE 102 102 27744 1 . LYS 103 103 27744 1 . PHE 104 104 27744 1 . ARG 105 105 27744 1 . PRO 106 106 27744 1 . GLY 107 107 27744 1 . THR 108 108 27744 1 . GLU 109 109 27744 1 . GLU 110 110 27744 1 . GLY 111 111 27744 1 . ASP 112 112 27744 1 . TYR 113 113 27744 1 . GLN 114 114 27744 1 . VAL 115 115 27744 1 . LYS 116 116 27744 1 . LEU 117 117 27744 1 . ARG 118 118 27744 1 . ASN 119 119 27744 1 . LEU 120 120 27744 1 . VAL 121 121 27744 1 . ARG 122 122 27744 1 . PHE 123 123 27744 1 . LEU 124 124 27744 1 . SER 125 125 27744 1 . GLU 126 126 27744 1 . GLY 127 127 27744 1 . ASP 128 128 27744 1 . LYS 129 129 27744 1 . ALA 130 130 27744 1 . LYS 131 131 27744 1 . VAL 132 132 27744 1 . SER 133 133 27744 1 . LEU 134 134 27744 1 . ARG 135 135 27744 1 . PHE 136 136 27744 1 . ARG 137 137 27744 1 . GLY 138 138 27744 1 . ARG 139 139 27744 1 . GLU 140 140 27744 1 . MET 141 141 27744 1 . ALA 142 142 27744 1 . HIS 143 143 27744 1 . GLN 144 144 27744 1 . GLU 145 145 27744 1 . LEU 146 146 27744 1 . GLY 147 147 27744 1 . MET 148 148 27744 1 . GLU 149 149 27744 1 . LEU 150 150 27744 1 . LEU 151 151 27744 1 . LYS 152 152 27744 1 . ARG 153 153 27744 1 . VAL 154 154 27744 1 . GLU 155 155 27744 1 . ALA 156 156 27744 1 . ASP 157 157 27744 1 . LEU 158 158 27744 1 . VAL 159 159 27744 1 . GLU 160 160 27744 1 . TYR 161 161 27744 1 . GLY 162 162 27744 1 . THR 163 163 27744 1 . VAL 164 164 27744 1 . GLU 165 165 27744 1 . GLN 166 166 27744 1 . HIS 167 167 27744 1 . PRO 168 168 27744 1 . LYS 169 169 27744 1 . LEU 170 170 27744 1 . GLU 171 171 27744 1 . GLY 172 172 27744 1 . ARG 173 173 27744 1 . GLN 174 174 27744 1 . LEU 175 175 27744 1 . MET 176 176 27744 1 . MET 177 177 27744 1 . VAL 178 178 27744 1 . ILE 179 179 27744 1 . ALA 180 180 27744 1 . PRO 181 181 27744 1 . LYS 182 182 27744 1 . LYS 183 183 27744 1 . LYS 184 184 27744 1 . LYS 185 185 27744 1 . LEU 186 186 27744 1 . GLU 187 187 27744 1 . HIS 188 188 27744 1 . HIS 189 189 27744 1 . HIS 190 190 27744 1 . HIS 191 191 27744 1 . HIS 192 192 27744 1 . HIS 193 193 27744 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 27744 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $PaIF3 . 287 organism . 'Pseudomonas aeruginosa' 'Pseudomonas aeruginosa' . . Bacteria . Pseudomonas aeruginosa . . . . . . . . . . . . . 27744 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 27744 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $PaIF3 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET24b . . . 27744 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27744 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 PaIF3 '[U-100% 13C; U-100% 15N]' . . 1 $PaIF3 . . 1 . . mM . . . . 27744 1 2 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 27744 1 3 'sodium chloride' 'natural abundance' . . . . . . 25 . . mM . . . . 27744 1 4 dithiothreitol-d10 'natural abundance' . . . . . . 10 . . mM . . . . 27744 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27744 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.05 . M 27744 1 pH 6.5 . pH 27744 1 pressure 1 . atm 27744 1 temperature 300 . K 27744 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27744 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27744 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 27744 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 27744 _Software.ID 2 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 27744 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 27744 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27744 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27744 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 27744 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27744 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27744 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27744 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27744 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27744 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27744 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27744 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27744 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27744 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27744 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27744 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27744 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27744 1 2 '3D CBCA(CO)NH' . . . 27744 1 3 '3D HNCACB' . . . 27744 1 4 '3D HNCO' . . . 27744 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 4 4 ILE H H 1 8.337 0.03 . 1 . . . . . 1 ILE H . 27744 1 2 . 1 . 1 4 4 ILE HA H 1 4.455 0.03 . 1 . . . . . 1 ILE HA . 27744 1 3 . 1 . 1 4 4 ILE HB H 1 2.104 0.03 . 1 . . . . . 1 ILE HB . 27744 1 4 . 1 . 1 4 4 ILE HD11 H 1 0.852 0.05 . 1 . . . . . 1 ILE HD11 . 27744 1 5 . 1 . 1 4 4 ILE HD12 H 1 0.852 0.05 . 1 . . . . . 1 ILE HD12 . 27744 1 6 . 1 . 1 4 4 ILE HD13 H 1 0.852 0.05 . 1 . . . . . 1 ILE HD13 . 27744 1 7 . 1 . 1 4 4 ILE C C 13 175.990 0.30 . 1 . . . . . 1 ILE C . 27744 1 8 . 1 . 1 4 4 ILE CA C 13 61.223 0.12 . 1 . . . . . 1 ILE CA . 27744 1 9 . 1 . 1 4 4 ILE CB C 13 38.745 0.04 . 1 . . . . . 1 ILE CB . 27744 1 10 . 1 . 1 4 4 ILE CD1 C 13 13.077 0.40 . 1 . . . . . 1 ILE CD1 . 27744 1 11 . 1 . 1 4 4 ILE N N 15 123.338 0.30 . 1 . . . . . 1 ILE N . 27744 1 12 . 1 . 1 5 5 ILE H H 1 8.285 0.03 . 1 . . . . . 2 ILE H . 27744 1 13 . 1 . 1 5 5 ILE HA H 1 4.386 0.03 . 1 . . . . . 2 ILE HA . 27744 1 14 . 1 . 1 5 5 ILE HB H 1 2.066 0.03 . 1 . . . . . 2 ILE HB . 27744 1 15 . 1 . 1 5 5 ILE HD11 H 1 0.836 0.03 . 1 . . . . . 2 ILE HD11 . 27744 1 16 . 1 . 1 5 5 ILE HD12 H 1 0.836 0.03 . 1 . . . . . 2 ILE HD12 . 27744 1 17 . 1 . 1 5 5 ILE HD13 H 1 0.836 0.03 . 1 . . . . . 2 ILE HD13 . 27744 1 18 . 1 . 1 5 5 ILE C C 13 175.888 0.30 . 1 . . . . . 2 ILE C . 27744 1 19 . 1 . 1 5 5 ILE CA C 13 60.913 0.05 . 1 . . . . . 2 ILE CA . 27744 1 20 . 1 . 1 5 5 ILE CB C 13 38.425 0.41 . 1 . . . . . 2 ILE CB . 27744 1 21 . 1 . 1 5 5 ILE CD1 C 13 12.977 0.40 . 1 . . . . . 2 ILE CD1 . 27744 1 22 . 1 . 1 5 5 ILE N N 15 126.016 0.30 . 1 . . . . . 2 ILE N . 27744 1 23 . 1 . 1 6 6 LYS H H 1 8.412 0.03 . 1 . . . . . 3 LYS H . 27744 1 24 . 1 . 1 6 6 LYS CA C 13 56.189 0.30 . 1 . . . . . 3 LYS CA . 27744 1 25 . 1 . 1 6 6 LYS CB C 13 32.993 0.30 . 1 . . . . . 3 LYS CB . 27744 1 26 . 1 . 1 6 6 LYS N N 15 126.955 0.30 . 1 . . . . . 3 LYS N . 27744 1 27 . 1 . 1 7 7 ARG H H 1 8.433 0.03 . 1 . . . . . 4 ARG H . 27744 1 28 . 1 . 1 7 7 ARG HA H 1 4.334 0.03 . 1 . . . . . 4 ARG HA . 27744 1 29 . 1 . 1 7 7 ARG HB2 H 1 1.851 0.03 . 2 . . . . . 4 ARG HB2 . 27744 1 30 . 1 . 1 7 7 ARG HB3 H 1 1.851 0.03 . 2 . . . . . 4 ARG HB3 . 27744 1 31 . 1 . 1 7 7 ARG C C 13 176.325 0.30 . 1 . . . . . 4 ARG C . 27744 1 32 . 1 . 1 7 7 ARG CA C 13 56.455 0.09 . 1 . . . . . 4 ARG CA . 27744 1 33 . 1 . 1 7 7 ARG CB C 13 30.526 0.26 . 1 . . . . . 4 ARG CB . 27744 1 34 . 1 . 1 7 7 ARG N N 15 123.421 0.30 . 1 . . . . . 4 ARG N . 27744 1 35 . 1 . 1 8 8 GLU H H 1 8.446 0.03 . 1 . . . . . 5 GLU H . 27744 1 36 . 1 . 1 8 8 GLU HA H 1 4.246 0.03 . 1 . . . . . 5 GLU HA . 27744 1 37 . 1 . 1 8 8 GLU HB2 H 1 1.842 0.03 . 2 . . . . . 5 GLU HB2 . 27744 1 38 . 1 . 1 8 8 GLU HB3 H 1 1.856 0.03 . 2 . . . . . 5 GLU HB3 . 27744 1 39 . 1 . 1 8 8 GLU C C 13 177.162 0.30 . 1 . . . . . 5 GLU C . 27744 1 40 . 1 . 1 8 8 GLU CA C 13 56.832 0.30 . 1 . . . . . 5 GLU CA . 27744 1 41 . 1 . 1 8 8 GLU CB C 13 32.860 0.30 . 1 . . . . . 5 GLU CB . 27744 1 42 . 1 . 1 8 8 GLU N N 15 122.273 0.30 . 1 . . . . . 5 GLU N . 27744 1 43 . 1 . 1 9 9 MET H H 1 8.182 0.03 . 1 . . . . . 6 MET H . 27744 1 44 . 1 . 1 9 9 MET HA H 1 4.558 0.03 . 1 . . . . . 6 MET HA . 27744 1 45 . 1 . 1 9 9 MET HB2 H 1 1.770 0.03 . 2 . . . . . 6 MET HB2 . 27744 1 46 . 1 . 1 9 9 MET HB3 H 1 1.779 0.03 . 2 . . . . . 6 MET HB3 . 27744 1 47 . 1 . 1 9 9 MET HE1 H 1 1.790 0.03 . 1 . . . . . 6 MET HE1 . 27744 1 48 . 1 . 1 9 9 MET HE2 H 1 1.790 0.03 . 1 . . . . . 6 MET HE2 . 27744 1 49 . 1 . 1 9 9 MET HE3 H 1 1.790 0.03 . 1 . . . . . 6 MET HE3 . 27744 1 50 . 1 . 1 9 9 MET C C 13 176.492 0.30 . 1 . . . . . 6 MET C . 27744 1 51 . 1 . 1 9 9 MET CA C 13 56.756 0.13 . 1 . . . . . 6 MET CA . 27744 1 52 . 1 . 1 9 9 MET CB C 13 32.886 0.14 . 1 . . . . . 6 MET CB . 27744 1 53 . 1 . 1 9 9 MET CE C 13 16.782 0.30 . 1 . . . . . 6 MET CE . 27744 1 54 . 1 . 1 9 9 MET N N 15 121.647 0.30 . 1 . . . . . 6 MET N . 27744 1 55 . 1 . 1 10 10 ARG H H 1 8.391 0.03 . 1 . . . . . 7 ARG H . 27744 1 56 . 1 . 1 10 10 ARG HA H 1 4.334 0.03 . 1 . . . . . 7 ARG HA . 27744 1 57 . 1 . 1 10 10 ARG HB2 H 1 1.851 0.03 . 2 . . . . . 7 ARG HB2 . 27744 1 58 . 1 . 1 10 10 ARG HB3 H 1 1.851 0.03 . 2 . . . . . 7 ARG HB3 . 27744 1 59 . 1 . 1 10 10 ARG C C 13 176.327 0.30 . 1 . . . . . 7 ARG C . 27744 1 60 . 1 . 1 10 10 ARG CA C 13 56.373 0.30 . 1 . . . . . 7 ARG CA . 27744 1 61 . 1 . 1 10 10 ARG CB C 13 30.709 0.30 . 1 . . . . . 7 ARG CB . 27744 1 62 . 1 . 1 10 10 ARG N N 15 122.093 0.30 . 1 . . . . . 7 ARG N . 27744 1 63 . 1 . 1 11 11 GLN H H 1 8.534 0.03 . 1 . . . . . 8 GLN H . 27744 1 64 . 1 . 1 11 11 GLN HA H 1 4.344 0.03 . 1 . . . . . 8 GLN HA . 27744 1 65 . 1 . 1 11 11 GLN HB2 H 1 2.046 0.03 . 2 . . . . . 8 GLN HB2 . 27744 1 66 . 1 . 1 11 11 GLN HB3 H 1 2.046 0.03 . 2 . . . . . 8 GLN HB3 . 27744 1 67 . 1 . 1 11 11 GLN C C 13 175.600 0.30 . 1 . . . . . 8 GLN C . 27744 1 68 . 1 . 1 11 11 GLN CA C 13 56.048 0.04 . 1 . . . . . 8 GLN CA . 27744 1 69 . 1 . 1 11 11 GLN CB C 13 29.370 0.05 . 1 . . . . . 8 GLN CB . 27744 1 70 . 1 . 1 11 11 GLN N N 15 121.938 0.30 . 1 . . . . . 8 GLN N . 27744 1 71 . 1 . 1 12 12 ASP H H 1 8.430 0.03 . 1 . . . . . 9 ASP H . 27744 1 72 . 1 . 1 12 12 ASP HA H 1 4.835 0.03 . 1 . . . . . 9 ASP HA . 27744 1 73 . 1 . 1 12 12 ASP HB2 H 1 2.913 0.03 . 2 . . . . . 9 ASP HB2 . 27744 1 74 . 1 . 1 12 12 ASP HB3 H 1 2.917 0.03 . 2 . . . . . 9 ASP HB3 . 27744 1 75 . 1 . 1 12 12 ASP C C 13 176.331 0.30 . 1 . . . . . 9 ASP C . 27744 1 76 . 1 . 1 12 12 ASP CA C 13 54.310 0.09 . 1 . . . . . 9 ASP CA . 27744 1 77 . 1 . 1 12 12 ASP CB C 13 41.212 0.30 . 1 . . . . . 9 ASP CB . 27744 1 78 . 1 . 1 12 12 ASP N N 15 121.707 0.30 . 1 . . . . . 9 ASP N . 27744 1 79 . 1 . 1 13 13 LYS H H 1 8.304 0.03 . 1 . . . . . 10 LYS H . 27744 1 80 . 1 . 1 13 13 LYS HA H 1 4.540 0.03 . 1 . . . . . 10 LYS HA . 27744 1 81 . 1 . 1 13 13 LYS HB2 H 1 2.094 0.03 . 2 . . . . . 10 LYS HB2 . 27744 1 82 . 1 . 1 13 13 LYS HB3 H 1 2.102 0.03 . 2 . . . . . 10 LYS HB3 . 27744 1 83 . 1 . 1 13 13 LYS C C 13 176.677 0.30 . 1 . . . . . 10 LYS C . 27744 1 84 . 1 . 1 13 13 LYS CA C 13 56.564 0.05 . 1 . . . . . 10 LYS CA . 27744 1 85 . 1 . 1 13 13 LYS CB C 13 32.674 0.30 . 1 . . . . . 10 LYS CB . 27744 1 86 . 1 . 1 13 13 LYS N N 15 122.059 0.30 . 1 . . . . . 10 LYS N . 27744 1 87 . 1 . 1 14 14 ARG H H 1 8.293 0.03 . 1 . . . . . 11 ARG H . 27744 1 88 . 1 . 1 14 14 ARG HA H 1 4.290 0.03 . 1 . . . . . 11 ARG HA . 27744 1 89 . 1 . 1 14 14 ARG HB2 H 1 1.848 0.03 . 2 . . . . . 11 ARG HB2 . 27744 1 90 . 1 . 1 14 14 ARG HB3 H 1 1.848 0.03 . 2 . . . . . 11 ARG HB3 . 27744 1 91 . 1 . 1 14 14 ARG HD2 H 1 3.191 0.03 . 2 . . . . . 11 ARG HD2 . 27744 1 92 . 1 . 1 14 14 ARG HD3 H 1 3.191 0.03 . 2 . . . . . 11 ARG HD3 . 27744 1 93 . 1 . 1 14 14 ARG HG2 H 1 1.776 0.03 . 2 . . . . . 11 ARG HG2 . 27744 1 94 . 1 . 1 14 14 ARG HG3 H 1 1.776 0.03 . 2 . . . . . 11 ARG HG3 . 27744 1 95 . 1 . 1 14 14 ARG C C 13 176.095 0.30 . 1 . . . . . 11 ARG C . 27744 1 96 . 1 . 1 14 14 ARG CA C 13 56.292 0.04 . 1 . . . . . 11 ARG CA . 27744 1 97 . 1 . 1 14 14 ARG CB C 13 30.663 0.30 . 1 . . . . . 11 ARG CB . 27744 1 98 . 1 . 1 14 14 ARG N N 15 121.557 0.30 . 1 . . . . . 11 ARG N . 27744 1 99 . 1 . 1 15 15 ALA H H 1 8.248 0.03 . 1 . . . . . 12 ALA H . 27744 1 100 . 1 . 1 15 15 ALA HA H 1 4.555 0.03 . 1 . . . . . 12 ALA HA . 27744 1 101 . 1 . 1 15 15 ALA HB1 H 1 1.630 0.03 . 1 . . . . . 12 ALA HB1 . 27744 1 102 . 1 . 1 15 15 ALA HB2 H 1 1.630 0.03 . 1 . . . . . 12 ALA HB2 . 27744 1 103 . 1 . 1 15 15 ALA HB3 H 1 1.630 0.03 . 1 . . . . . 12 ALA HB3 . 27744 1 104 . 1 . 1 15 15 ALA C C 13 177.364 0.30 . 1 . . . . . 12 ALA C . 27744 1 105 . 1 . 1 15 15 ALA CA C 13 52.333 0.10 . 1 . . . . . 12 ALA CA . 27744 1 106 . 1 . 1 15 15 ALA CB C 13 19.238 0.30 . 1 . . . . . 12 ALA CB . 27744 1 107 . 1 . 1 15 15 ALA N N 15 125.018 0.30 . 1 . . . . . 12 ALA N . 27744 1 108 . 1 . 1 16 16 GLN H H 1 8.302 0.03 . 1 . . . . . 13 GLN H . 27744 1 109 . 1 . 1 16 16 GLN HA H 1 4.326 0.03 . 1 . . . . . 13 GLN HA . 27744 1 110 . 1 . 1 16 16 GLN HB2 H 1 1.985 0.03 . 2 . . . . . 13 GLN HB2 . 27744 1 111 . 1 . 1 16 16 GLN HB3 H 1 2.011 0.03 . 2 . . . . . 13 GLN HB3 . 27744 1 112 . 1 . 1 16 16 GLN HG2 H 1 2.349 0.03 . 2 . . . . . 13 GLN HG2 . 27744 1 113 . 1 . 1 16 16 GLN HG3 H 1 2.349 0.03 . 2 . . . . . 13 GLN HG3 . 27744 1 114 . 1 . 1 16 16 GLN CA C 13 53.572 0.30 . 1 . . . . . 13 GLN CA . 27744 1 115 . 1 . 1 16 16 GLN CB C 13 28.986 0.30 . 1 . . . . . 13 GLN CB . 27744 1 116 . 1 . 1 16 16 GLN CG C 13 22.190 0.30 . 1 . . . . . 13 GLN CG . 27744 1 117 . 1 . 1 16 16 GLN N N 15 120.930 0.30 . 1 . . . . . 13 GLN N . 27744 1 118 . 1 . 1 17 17 PRO HA H 1 4.466 0.03 . 1 . . . . . 14 PRO HA . 27744 1 119 . 1 . 1 17 17 PRO HB2 H 1 1.904 0.03 . 2 . . . . . 14 PRO HB2 . 27744 1 120 . 1 . 1 17 17 PRO HB3 H 1 2.297 0.03 . 2 . . . . . 14 PRO HB3 . 27744 1 121 . 1 . 1 17 17 PRO HD2 H 1 3.768 0.03 . 2 . . . . . 14 PRO HD2 . 27744 1 122 . 1 . 1 17 17 PRO HD3 H 1 3.783 0.03 . 2 . . . . . 14 PRO HD3 . 27744 1 123 . 1 . 1 17 17 PRO HG2 H 1 2.040 0.03 . 2 . . . . . 14 PRO HG2 . 27744 1 124 . 1 . 1 17 17 PRO HG3 H 1 2.040 0.03 . 2 . . . . . 14 PRO HG3 . 27744 1 125 . 1 . 1 17 17 PRO C C 13 176.167 0.30 . 1 . . . . . 14 PRO C . 27744 1 126 . 1 . 1 17 17 PRO CA C 13 63.228 0.30 . 1 . . . . . 14 PRO CA . 27744 1 127 . 1 . 1 17 17 PRO CB C 13 32.288 0.30 . 1 . . . . . 14 PRO CB . 27744 1 128 . 1 . 1 17 17 PRO CD C 13 48.223 0.30 . 1 . . . . . 14 PRO CD . 27744 1 129 . 1 . 1 17 17 PRO CG C 13 25.961 0.30 . 1 . . . . . 14 PRO CG . 27744 1 130 . 1 . 1 18 18 LYS H H 1 8.439 0.01 . 1 . . . . . 15 LYS H . 27744 1 131 . 1 . 1 18 18 LYS HA H 1 4.512 0.05 . 1 . . . . . 15 LYS HA . 27744 1 132 . 1 . 1 18 18 LYS HB2 H 1 1.713 0.05 . 2 . . . . . 15 LYS HB2 . 27744 1 133 . 1 . 1 18 18 LYS HB3 H 1 1.713 0.05 . 2 . . . . . 15 LYS HB3 . 27744 1 134 . 1 . 1 18 18 LYS HD2 H 1 1.694 0.05 . 2 . . . . . 15 LYS HD2 . 27744 1 135 . 1 . 1 18 18 LYS HD3 H 1 1.694 0.05 . 2 . . . . . 15 LYS HD3 . 27744 1 136 . 1 . 1 18 18 LYS HE2 H 1 2.966 0.05 . 2 . . . . . 15 LYS HE2 . 27744 1 137 . 1 . 1 18 18 LYS HE3 H 1 2.966 0.05 . 2 . . . . . 15 LYS HE3 . 27744 1 138 . 1 . 1 18 18 LYS HG2 H 1 1.528 0.05 . 2 . . . . . 15 LYS HG2 . 27744 1 139 . 1 . 1 18 18 LYS HG3 H 1 1.528 0.05 . 2 . . . . . 15 LYS HG3 . 27744 1 140 . 1 . 1 18 18 LYS CA C 13 54.074 0.30 . 1 . . . . . 15 LYS CA . 27744 1 141 . 1 . 1 18 18 LYS CB C 13 32.551 0.30 . 1 . . . . . 15 LYS CB . 27744 1 142 . 1 . 1 18 18 LYS CD C 13 30.559 0.30 . 1 . . . . . 15 LYS CD . 27744 1 143 . 1 . 1 18 18 LYS CE C 13 40.324 0.30 . 1 . . . . . 15 LYS CE . 27744 1 144 . 1 . 1 18 18 LYS N N 15 122.748 0.10 . 1 . . . . . 15 LYS N . 27744 1 145 . 1 . 1 20 20 PRO HA H 1 4.258 0.03 . 1 . . . . . 17 PRO HA . 27744 1 146 . 1 . 1 20 20 PRO HB2 H 1 1.846 0.03 . 2 . . . . . 17 PRO HB2 . 27744 1 147 . 1 . 1 20 20 PRO HB3 H 1 1.882 0.03 . 2 . . . . . 17 PRO HB3 . 27744 1 148 . 1 . 1 20 20 PRO C C 13 176.668 0.30 . 1 . . . . . 17 PRO C . 27744 1 149 . 1 . 1 21 21 ILE H H 1 8.377 0.03 . 1 . . . . . 18 ILE H . 27744 1 150 . 1 . 1 21 21 ILE HA H 1 4.851 0.03 . 1 . . . . . 18 ILE HA . 27744 1 151 . 1 . 1 21 21 ILE HB H 1 2.104 0.03 . 1 . . . . . 18 ILE HB . 27744 1 152 . 1 . 1 21 21 ILE HD11 H 1 0.661 0.03 . 1 . . . . . 18 ILE HD11 . 27744 1 153 . 1 . 1 21 21 ILE HD12 H 1 0.661 0.03 . 1 . . . . . 18 ILE HD12 . 27744 1 154 . 1 . 1 21 21 ILE HD13 H 1 0.661 0.03 . 1 . . . . . 18 ILE HD13 . 27744 1 155 . 1 . 1 21 21 ILE C C 13 174.636 0.30 . 1 . . . . . 18 ILE C . 27744 1 156 . 1 . 1 21 21 ILE CA C 13 53.343 0.09 . 1 . . . . . 18 ILE CA . 27744 1 157 . 1 . 1 21 21 ILE CB C 13 38.643 0.30 . 1 . . . . . 18 ILE CB . 27744 1 158 . 1 . 1 21 21 ILE CD1 C 13 13.526 0.30 . 1 . . . . . 18 ILE CD1 . 27744 1 159 . 1 . 1 21 21 ILE N N 15 119.136 0.30 . 1 . . . . . 18 ILE N . 27744 1 160 . 1 . 1 23 23 GLU H H 1 9.081 0.03 . 1 . . . . . 20 GLU H . 27744 1 161 . 1 . 1 23 23 GLU HA H 1 4.504 0.03 . 1 . . . . . 20 GLU HA . 27744 1 162 . 1 . 1 23 23 GLU HB2 H 1 2.092 0.03 . 2 . . . . . 20 GLU HB2 . 27744 1 163 . 1 . 1 23 23 GLU HB3 H 1 2.128 0.03 . 2 . . . . . 20 GLU HB3 . 27744 1 164 . 1 . 1 23 23 GLU C C 13 176.668 0.30 . 1 . . . . . 20 GLU C . 27744 1 165 . 1 . 1 23 23 GLU CA C 13 56.979 0.00 . 1 . . . . . 20 GLU CA . 27744 1 166 . 1 . 1 23 23 GLU CB C 13 32.852 0.30 . 1 . . . . . 20 GLU CB . 27744 1 167 . 1 . 1 23 23 GLU N N 15 128.865 0.30 . 1 . . . . . 20 GLU N . 27744 1 168 . 1 . 1 24 24 ASN H H 1 8.377 0.03 . 1 . . . . . 21 ASN H . 27744 1 169 . 1 . 1 24 24 ASN HA H 1 4.839 0.03 . 1 . . . . . 21 ASN HA . 27744 1 170 . 1 . 1 24 24 ASN HB2 H 1 2.936 0.03 . 2 . . . . . 21 ASN HB2 . 27744 1 171 . 1 . 1 24 24 ASN HB3 H 1 2.933 0.03 . 2 . . . . . 21 ASN HB3 . 27744 1 172 . 1 . 1 24 24 ASN C C 13 176.238 0.30 . 1 . . . . . 21 ASN C . 27744 1 173 . 1 . 1 24 24 ASN CA C 13 54.719 0.30 . 1 . . . . . 21 ASN CA . 27744 1 174 . 1 . 1 24 24 ASN CB C 13 41.124 0.30 . 1 . . . . . 21 ASN CB . 27744 1 175 . 1 . 1 24 24 ASN N N 15 119.154 0.30 . 1 . . . . . 21 ASN N . 27744 1 176 . 1 . 1 25 25 ILE H H 1 8.031 0.03 . 1 . . . . . 22 ILE H . 27744 1 177 . 1 . 1 25 25 ILE HA H 1 4.215 0.03 . 1 . . . . . 22 ILE HA . 27744 1 178 . 1 . 1 25 25 ILE HD11 H 1 0.895 0.03 . 1 . . . . . 22 ILE HD11 . 27744 1 179 . 1 . 1 25 25 ILE HD12 H 1 0.895 0.03 . 1 . . . . . 22 ILE HD12 . 27744 1 180 . 1 . 1 25 25 ILE HD13 H 1 0.895 0.03 . 1 . . . . . 22 ILE HD13 . 27744 1 181 . 1 . 1 25 25 ILE CA C 13 55.146 0.30 . 1 . . . . . 22 ILE CA . 27744 1 182 . 1 . 1 25 25 ILE CB C 13 42.203 0.30 . 1 . . . . . 22 ILE CB . 27744 1 183 . 1 . 1 25 25 ILE CD1 C 13 13.299 0.30 . 1 . . . . . 22 ILE CD1 . 27744 1 184 . 1 . 1 25 25 ILE N N 15 121.920 0.30 . 1 . . . . . 22 ILE N . 27744 1 185 . 1 . 1 26 26 SER HA H 1 4.451 0.03 . 1 . . . . . 23 SER HA . 27744 1 186 . 1 . 1 26 26 SER HB2 H 1 3.886 0.03 . 2 . . . . . 23 SER HB2 . 27744 1 187 . 1 . 1 26 26 SER HB3 H 1 3.886 0.03 . 2 . . . . . 23 SER HB3 . 27744 1 188 . 1 . 1 26 26 SER C C 13 174.313 0.30 . 1 . . . . . 23 SER C . 27744 1 189 . 1 . 1 26 26 SER CA C 13 58.258 0.30 . 1 . . . . . 23 SER CA . 27744 1 190 . 1 . 1 26 26 SER CB C 13 64.127 0.30 . 1 . . . . . 23 SER CB . 27744 1 191 . 1 . 1 27 27 ALA H H 1 7.210 0.01 . 1 . . . . . 24 ALA H . 27744 1 192 . 1 . 1 27 27 ALA HA H 1 4.536 0.03 . 1 . . . . . 24 ALA HA . 27744 1 193 . 1 . 1 27 27 ALA HB1 H 1 1.574 0.03 . 1 . . . . . 24 ALA HB1 . 27744 1 194 . 1 . 1 27 27 ALA HB2 H 1 1.589 0.03 . 1 . . . . . 24 ALA HB2 . 27744 1 195 . 1 . 1 27 27 ALA HB3 H 1 1.576 0.03 . 1 . . . . . 24 ALA HB3 . 27744 1 196 . 1 . 1 27 27 ALA C C 13 176.437 0.30 . 1 . . . . . 24 ALA C . 27744 1 197 . 1 . 1 27 27 ALA CA C 13 52.531 0.11 . 1 . . . . . 24 ALA CA . 27744 1 198 . 1 . 1 27 27 ALA CB C 13 20.134 0.32 . 1 . . . . . 24 ALA CB . 27744 1 199 . 1 . 1 27 27 ALA N N 15 126.444 0.30 . 1 . . . . . 24 ALA N . 27744 1 200 . 1 . 1 28 28 ARG H H 1 8.538 0.03 . 1 . . . . . 25 ARG H . 27744 1 201 . 1 . 1 28 28 ARG HA H 1 4.343 0.03 . 1 . . . . . 25 ARG HA . 27744 1 202 . 1 . 1 28 28 ARG HB2 H 1 1.884 0.03 . 2 . . . . . 25 ARG HB2 . 27744 1 203 . 1 . 1 28 28 ARG HB3 H 1 1.884 0.03 . 2 . . . . . 25 ARG HB3 . 27744 1 204 . 1 . 1 28 28 ARG C C 13 177.509 0.30 . 1 . . . . . 25 ARG C . 27744 1 205 . 1 . 1 28 28 ARG CA C 13 56.546 0.07 . 1 . . . . . 25 ARG CA . 27744 1 206 . 1 . 1 28 28 ARG CB C 13 30.512 0.30 . 1 . . . . . 25 ARG CB . 27744 1 207 . 1 . 1 28 28 ARG N N 15 117.087 0.30 . 1 . . . . . 25 ARG N . 27744 1 208 . 1 . 1 29 29 GLU H H 1 7.588 0.01 . 1 . . . . . 26 GLU H . 27744 1 209 . 1 . 1 29 29 GLU HA H 1 4.911 0.03 . 1 . . . . . 26 GLU HA . 27744 1 210 . 1 . 1 29 29 GLU HB2 H 1 1.803 0.03 . 2 . . . . . 26 GLU HB2 . 27744 1 211 . 1 . 1 29 29 GLU HB3 H 1 1.766 0.03 . 2 . . . . . 26 GLU HB3 . 27744 1 212 . 1 . 1 29 29 GLU HG2 H 1 1.980 0.03 . 2 . . . . . 26 GLU HG2 . 27744 1 213 . 1 . 1 29 29 GLU HG3 H 1 1.980 0.03 . 2 . . . . . 26 GLU HG3 . 27744 1 214 . 1 . 1 29 29 GLU C C 13 174.427 0.30 . 1 . . . . . 26 GLU C . 27744 1 215 . 1 . 1 29 29 GLU CA C 13 55.069 0.05 . 1 . . . . . 26 GLU CA . 27744 1 216 . 1 . 1 29 29 GLU CB C 13 32.843 0.08 . 1 . . . . . 26 GLU CB . 27744 1 217 . 1 . 1 29 29 GLU CG C 13 36.202 0.50 . 1 . . . . . 26 GLU CG . 27744 1 218 . 1 . 1 29 29 GLU N N 15 119.136 0.30 . 1 . . . . . 26 GLU N . 27744 1 219 . 1 . 1 30 30 VAL H H 1 9.005 0.03 . 1 . . . . . 27 VAL H . 27744 1 220 . 1 . 1 30 30 VAL HA H 1 5.132 0.03 . 1 . . . . . 27 VAL HA . 27744 1 221 . 1 . 1 30 30 VAL HB H 1 2.271 0.03 . 1 . . . . . 27 VAL HB . 27744 1 222 . 1 . 1 30 30 VAL HG11 H 1 0.532 0.03 . 2 . . . . . 27 VAL HG11 . 27744 1 223 . 1 . 1 30 30 VAL HG12 H 1 0.532 0.03 . 2 . . . . . 27 VAL HG12 . 27744 1 224 . 1 . 1 30 30 VAL HG13 H 1 0.532 0.03 . 2 . . . . . 27 VAL HG13 . 27744 1 225 . 1 . 1 30 30 VAL HG21 H 1 0.700 0.03 . 2 . . . . . 27 VAL HG21 . 27744 1 226 . 1 . 1 30 30 VAL HG22 H 1 0.700 0.03 . 2 . . . . . 27 VAL HG22 . 27744 1 227 . 1 . 1 30 30 VAL HG23 H 1 0.700 0.03 . 2 . . . . . 27 VAL HG23 . 27744 1 228 . 1 . 1 30 30 VAL C C 13 173.356 0.30 . 1 . . . . . 27 VAL C . 27744 1 229 . 1 . 1 30 30 VAL CA C 13 58.520 0.04 . 1 . . . . . 27 VAL CA . 27744 1 230 . 1 . 1 30 30 VAL CB C 13 35.428 0.30 . 1 . . . . . 27 VAL CB . 27744 1 231 . 1 . 1 30 30 VAL CG1 C 13 18.366 0.30 . 1 . . . . . 27 VAL CG1 . 27744 1 232 . 1 . 1 30 30 VAL CG2 C 13 23.358 0.30 . 1 . . . . . 27 VAL CG2 . 27744 1 233 . 1 . 1 30 30 VAL N N 15 112.031 0.30 . 1 . . . . . 27 VAL N . 27744 1 234 . 1 . 1 31 31 ARG H H 1 9.099 0.01 . 1 . . . . . 28 ARG H . 27744 1 235 . 1 . 1 31 31 ARG HA H 1 4.457 0.03 . 1 . . . . . 28 ARG HA . 27744 1 236 . 1 . 1 31 31 ARG HB2 H 1 1.810 0.03 . 2 . . . . . 28 ARG HB2 . 27744 1 237 . 1 . 1 31 31 ARG HB3 H 1 1.810 0.03 . 2 . . . . . 28 ARG HB3 . 27744 1 238 . 1 . 1 31 31 ARG C C 13 173.784 0.30 . 1 . . . . . 28 ARG C . 27744 1 239 . 1 . 1 31 31 ARG CA C 13 56.241 0.17 . 1 . . . . . 28 ARG CA . 27744 1 240 . 1 . 1 31 31 ARG CB C 13 30.611 0.02 . 1 . . . . . 28 ARG CB . 27744 1 241 . 1 . 1 31 31 ARG N N 15 123.831 0.30 . 1 . . . . . 28 ARG N . 27744 1 242 . 1 . 1 32 32 LEU H H 1 8.722 0.03 . 1 . . . . . 29 LEU H . 27744 1 243 . 1 . 1 32 32 LEU HA H 1 5.143 0.03 . 1 . . . . . 29 LEU HA . 27744 1 244 . 1 . 1 32 32 LEU HB2 H 1 2.254 0.03 . 2 . . . . . 29 LEU HB2 . 27744 1 245 . 1 . 1 32 32 LEU HB3 H 1 2.264 0.03 . 2 . . . . . 29 LEU HB3 . 27744 1 246 . 1 . 1 32 32 LEU HD11 H 1 0.833 0.05 . 2 . . . . . 29 LEU HD11 . 27744 1 247 . 1 . 1 32 32 LEU HD12 H 1 0.833 0.05 . 2 . . . . . 29 LEU HD12 . 27744 1 248 . 1 . 1 32 32 LEU HD13 H 1 0.833 0.05 . 2 . . . . . 29 LEU HD13 . 27744 1 249 . 1 . 1 32 32 LEU HG H 1 1.394 0.05 . 1 . . . . . 29 LEU HG . 27744 1 250 . 1 . 1 32 32 LEU C C 13 175.023 0.30 . 1 . . . . . 29 LEU C . 27744 1 251 . 1 . 1 32 32 LEU CA C 13 54.221 0.08 . 1 . . . . . 29 LEU CA . 27744 1 252 . 1 . 1 32 32 LEU CB C 13 46.239 0.01 . 1 . . . . . 29 LEU CB . 27744 1 253 . 1 . 1 32 32 LEU N N 15 128.797 0.11 . 1 . . . . . 29 LEU N . 27744 1 254 . 1 . 1 33 33 ILE H H 1 9.084 0.01 . 1 . . . . . 30 ILE H . 27744 1 255 . 1 . 1 33 33 ILE HA H 1 4.713 0.03 . 1 . . . . . 30 ILE HA . 27744 1 256 . 1 . 1 33 33 ILE HB H 1 1.924 0.03 . 1 . . . . . 30 ILE HB . 27744 1 257 . 1 . 1 33 33 ILE HD11 H 1 0.733 0.05 . 1 . . . . . 30 ILE HD11 . 27744 1 258 . 1 . 1 33 33 ILE HD12 H 1 0.733 0.05 . 1 . . . . . 30 ILE HD12 . 27744 1 259 . 1 . 1 33 33 ILE HD13 H 1 0.733 0.05 . 1 . . . . . 30 ILE HD13 . 27744 1 260 . 1 . 1 33 33 ILE C C 13 176.053 0.30 . 1 . . . . . 30 ILE C . 27744 1 261 . 1 . 1 33 33 ILE CA C 13 60.335 0.08 . 1 . . . . . 30 ILE CA . 27744 1 262 . 1 . 1 33 33 ILE CB C 13 38.662 0.01 . 1 . . . . . 30 ILE CB . 27744 1 263 . 1 . 1 33 33 ILE CD1 C 13 12.632 0.30 . 1 . . . . . 30 ILE CD1 . 27744 1 264 . 1 . 1 33 33 ILE N N 15 129.553 0.30 . 1 . . . . . 30 ILE N . 27744 1 265 . 1 . 1 34 34 GLY H H 1 8.905 0.01 . 1 . . . . . 31 GLY H . 27744 1 266 . 1 . 1 34 34 GLY HA2 H 1 4.305 0.03 . 2 . . . . . 31 GLY HA2 . 27744 1 267 . 1 . 1 34 34 GLY HA3 H 1 4.330 0.03 . 2 . . . . . 31 GLY HA3 . 27744 1 268 . 1 . 1 34 34 GLY C C 13 174.823 0.30 . 1 . . . . . 31 GLY C . 27744 1 269 . 1 . 1 34 34 GLY CA C 13 44.307 0.14 . 1 . . . . . 31 GLY CA . 27744 1 270 . 1 . 1 34 34 GLY N N 15 111.578 0.30 . 1 . . . . . 31 GLY N . 27744 1 271 . 1 . 1 35 35 ALA H H 1 9.155 0.03 . 1 . . . . . 32 ALA H . 27744 1 272 . 1 . 1 35 35 ALA HA H 1 4.609 0.03 . 1 . . . . . 32 ALA HA . 27744 1 273 . 1 . 1 35 35 ALA HB1 H 1 1.573 0.03 . 1 . . . . . 32 ALA HB1 . 27744 1 274 . 1 . 1 35 35 ALA HB2 H 1 1.573 0.03 . 1 . . . . . 32 ALA HB2 . 27744 1 275 . 1 . 1 35 35 ALA HB3 H 1 1.573 0.03 . 1 . . . . . 32 ALA HB3 . 27744 1 276 . 1 . 1 35 35 ALA C C 13 178.541 0.30 . 1 . . . . . 32 ALA C . 27744 1 277 . 1 . 1 35 35 ALA CA C 13 54.691 0.04 . 1 . . . . . 32 ALA CA . 27744 1 278 . 1 . 1 35 35 ALA CB C 13 18.150 0.06 . 1 . . . . . 32 ALA CB . 27744 1 279 . 1 . 1 35 35 ALA N N 15 122.804 0.30 . 1 . . . . . 32 ALA N . 27744 1 280 . 1 . 1 36 36 ASP H H 1 8.172 0.03 . 1 . . . . . 33 ASP H . 27744 1 281 . 1 . 1 36 36 ASP HA H 1 4.856 0.03 . 1 . . . . . 33 ASP HA . 27744 1 282 . 1 . 1 36 36 ASP HB2 H 1 2.951 0.03 . 2 . . . . . 33 ASP HB2 . 27744 1 283 . 1 . 1 36 36 ASP HB3 H 1 3.166 0.03 . 2 . . . . . 33 ASP HB3 . 27744 1 284 . 1 . 1 36 36 ASP C C 13 177.171 0.30 . 1 . . . . . 33 ASP C . 27744 1 285 . 1 . 1 36 36 ASP CA C 13 53.045 0.30 . 1 . . . . . 33 ASP CA . 27744 1 286 . 1 . 1 36 36 ASP CB C 13 40.270 0.30 . 1 . . . . . 33 ASP CB . 27744 1 287 . 1 . 1 36 36 ASP N N 15 114.726 0.30 . 1 . . . . . 33 ASP N . 27744 1 288 . 1 . 1 37 37 GLY H H 1 8.109 0.03 . 1 . . . . . 34 GLY H . 27744 1 289 . 1 . 1 37 37 GLY HA2 H 1 3.622 0.03 . 2 . . . . . 34 GLY HA2 . 27744 1 290 . 1 . 1 37 37 GLY HA3 H 1 4.507 0.03 . 2 . . . . . 34 GLY HA3 . 27744 1 291 . 1 . 1 37 37 GLY C C 13 173.897 0.30 . 1 . . . . . 34 GLY C . 27744 1 292 . 1 . 1 37 37 GLY CA C 13 45.219 0.30 . 1 . . . . . 34 GLY CA . 27744 1 293 . 1 . 1 37 37 GLY N N 15 107.818 0.30 . 1 . . . . . 34 GLY N . 27744 1 294 . 1 . 1 38 38 GLN H H 1 8.254 0.03 . 1 . . . . . 35 GLN H . 27744 1 295 . 1 . 1 38 38 GLN HA H 1 4.377 0.03 . 1 . . . . . 35 GLN HA . 27744 1 296 . 1 . 1 38 38 GLN HB2 H 1 2.021 0.03 . 2 . . . . . 35 GLN HB2 . 27744 1 297 . 1 . 1 38 38 GLN HB3 H 1 2.015 0.03 . 2 . . . . . 35 GLN HB3 . 27744 1 298 . 1 . 1 38 38 GLN HG2 H 1 2.299 0.03 . 2 . . . . . 35 GLN HG2 . 27744 1 299 . 1 . 1 38 38 GLN HG3 H 1 2.299 0.03 . 2 . . . . . 35 GLN HG3 . 27744 1 300 . 1 . 1 38 38 GLN C C 13 176.195 0.30 . 1 . . . . . 35 GLN C . 27744 1 301 . 1 . 1 38 38 GLN CA C 13 54.973 0.01 . 1 . . . . . 35 GLN CA . 27744 1 302 . 1 . 1 38 38 GLN CB C 13 29.154 0.04 . 1 . . . . . 35 GLN CB . 27744 1 303 . 1 . 1 38 38 GLN N N 15 120.050 0.30 . 1 . . . . . 35 GLN N . 27744 1 304 . 1 . 1 39 39 GLN H H 1 9.083 0.01 . 1 . . . . . 36 GLN H . 27744 1 305 . 1 . 1 39 39 GLN HA H 1 4.343 0.03 . 1 . . . . . 36 GLN HA . 27744 1 306 . 1 . 1 39 39 GLN HB2 H 1 2.059 0.03 . 2 . . . . . 36 GLN HB2 . 27744 1 307 . 1 . 1 39 39 GLN HB3 H 1 2.077 0.03 . 2 . . . . . 36 GLN HB3 . 27744 1 308 . 1 . 1 39 39 GLN HG2 H 1 2.389 0.03 . 2 . . . . . 36 GLN HG2 . 27744 1 309 . 1 . 1 39 39 GLN HG3 H 1 2.415 0.03 . 2 . . . . . 36 GLN HG3 . 27744 1 310 . 1 . 1 39 39 GLN C C 13 176.043 0.30 . 1 . . . . . 36 GLN C . 27744 1 311 . 1 . 1 39 39 GLN CA C 13 56.863 0.06 . 1 . . . . . 36 GLN CA . 27744 1 312 . 1 . 1 39 39 GLN CB C 13 28.149 0.01 . 1 . . . . . 36 GLN CB . 27744 1 313 . 1 . 1 39 39 GLN N N 15 124.096 0.30 . 1 . . . . . 36 GLN N . 27744 1 314 . 1 . 1 40 40 VAL H H 1 8.797 0.01 . 1 . . . . . 37 VAL H . 27744 1 315 . 1 . 1 40 40 VAL HA H 1 4.395 0.20 . 1 . . . . . 37 VAL HA . 27744 1 316 . 1 . 1 40 40 VAL HB H 1 2.115 0.03 . 1 . . . . . 37 VAL HB . 27744 1 317 . 1 . 1 40 40 VAL HG11 H 1 0.920 0.03 . 2 . . . . . 37 VAL HG11 . 27744 1 318 . 1 . 1 40 40 VAL HG12 H 1 0.920 0.03 . 2 . . . . . 37 VAL HG12 . 27744 1 319 . 1 . 1 40 40 VAL HG13 H 1 0.920 0.03 . 2 . . . . . 37 VAL HG13 . 27744 1 320 . 1 . 1 40 40 VAL HG21 H 1 0.855 0.03 . 2 . . . . . 37 VAL HG21 . 27744 1 321 . 1 . 1 40 40 VAL HG22 H 1 0.855 0.03 . 2 . . . . . 37 VAL HG22 . 27744 1 322 . 1 . 1 40 40 VAL HG23 H 1 0.855 0.03 . 2 . . . . . 37 VAL HG23 . 27744 1 323 . 1 . 1 40 40 VAL C C 13 176.172 0.30 . 1 . . . . . 37 VAL C . 27744 1 324 . 1 . 1 40 40 VAL CA C 13 64.237 0.30 . 1 . . . . . 37 VAL CA . 27744 1 325 . 1 . 1 40 40 VAL CB C 13 32.614 0.30 . 1 . . . . . 37 VAL CB . 27744 1 326 . 1 . 1 40 40 VAL CG2 C 13 20.779 0.30 . 1 . . . . . 37 VAL CG2 . 27744 1 327 . 1 . 1 40 40 VAL N N 15 127.782 0.30 . 1 . . . . . 37 VAL N . 27744 1 328 . 1 . 1 41 41 GLY H H 1 7.449 0.03 . 1 . . . . . 38 GLY H . 27744 1 329 . 1 . 1 41 41 GLY HA2 H 1 4.045 0.03 . 2 . . . . . 38 GLY HA2 . 27744 1 330 . 1 . 1 41 41 GLY HA3 H 1 4.650 0.03 . 2 . . . . . 38 GLY HA3 . 27744 1 331 . 1 . 1 41 41 GLY C C 13 171.946 0.03 . 1 . . . . . 38 GLY C . 27744 1 332 . 1 . 1 41 41 GLY CA C 13 43.575 0.02 . 1 . . . . . 38 GLY CA . 27744 1 333 . 1 . 1 41 41 GLY N N 15 105.199 0.30 . 1 . . . . . 38 GLY N . 27744 1 334 . 1 . 1 42 42 VAL H H 1 8.501 0.03 . 1 . . . . . 39 VAL H . 27744 1 335 . 1 . 1 42 42 VAL HA H 1 5.110 0.03 . 1 . . . . . 39 VAL HA . 27744 1 336 . 1 . 1 42 42 VAL HB H 1 2.184 0.03 . 1 . . . . . 39 VAL HB . 27744 1 337 . 1 . 1 42 42 VAL HG11 H 1 0.842 0.03 . 2 . . . . . 39 VAL HG11 . 27744 1 338 . 1 . 1 42 42 VAL HG12 H 1 0.842 0.03 . 2 . . . . . 39 VAL HG12 . 27744 1 339 . 1 . 1 42 42 VAL HG13 H 1 0.842 0.03 . 2 . . . . . 39 VAL HG13 . 27744 1 340 . 1 . 1 42 42 VAL HG21 H 1 0.725 0.03 . 2 . . . . . 39 VAL HG21 . 27744 1 341 . 1 . 1 42 42 VAL HG22 H 1 0.725 0.03 . 2 . . . . . 39 VAL HG22 . 27744 1 342 . 1 . 1 42 42 VAL HG23 H 1 0.725 0.03 . 2 . . . . . 39 VAL HG23 . 27744 1 343 . 1 . 1 42 42 VAL C C 13 176.688 0.30 . 1 . . . . . 39 VAL C . 27744 1 344 . 1 . 1 42 42 VAL CA C 13 62.685 0.05 . 1 . . . . . 39 VAL CA . 27744 1 345 . 1 . 1 42 42 VAL CB C 13 31.008 0.16 . 1 . . . . . 39 VAL CB . 27744 1 346 . 1 . 1 42 42 VAL CG1 C 13 21.373 0.16 . 1 . . . . . 39 VAL CG1 . 27744 1 347 . 1 . 1 42 42 VAL CG2 C 13 21.331 0.16 . 1 . . . . . 39 VAL CG2 . 27744 1 348 . 1 . 1 42 42 VAL N N 15 121.808 0.30 . 1 . . . . . 39 VAL N . 27744 1 349 . 1 . 1 43 43 VAL H H 1 8.988 0.01 . 1 . . . . . 40 VAL H . 27744 1 350 . 1 . 1 43 43 VAL HA H 1 5.087 0.03 . 1 . . . . . 40 VAL HA . 27744 1 351 . 1 . 1 43 43 VAL HB H 1 2.488 0.03 . 1 . . . . . 40 VAL HB . 27744 1 352 . 1 . 1 43 43 VAL HG11 H 1 0.764 0.03 . 2 . . . . . 40 VAL HG11 . 27744 1 353 . 1 . 1 43 43 VAL HG12 H 1 0.764 0.03 . 2 . . . . . 40 VAL HG12 . 27744 1 354 . 1 . 1 43 43 VAL HG13 H 1 0.764 0.03 . 2 . . . . . 40 VAL HG13 . 27744 1 355 . 1 . 1 43 43 VAL HG21 H 1 0.725 0.03 . 2 . . . . . 40 VAL HG21 . 27744 1 356 . 1 . 1 43 43 VAL HG22 H 1 0.725 0.03 . 2 . . . . . 40 VAL HG22 . 27744 1 357 . 1 . 1 43 43 VAL HG23 H 1 0.725 0.03 . 2 . . . . . 40 VAL HG23 . 27744 1 358 . 1 . 1 43 43 VAL C C 13 174.704 0.30 . 1 . . . . . 40 VAL C . 27744 1 359 . 1 . 1 43 43 VAL CA C 13 58.393 0.04 . 1 . . . . . 40 VAL CA . 27744 1 360 . 1 . 1 43 43 VAL CB C 13 36.660 0.30 . 1 . . . . . 40 VAL CB . 27744 1 361 . 1 . 1 43 43 VAL CG1 C 13 21.748 0.30 . 1 . . . . . 40 VAL CG1 . 27744 1 362 . 1 . 1 43 43 VAL CG2 C 13 19.771 0.30 . 1 . . . . . 40 VAL CG2 . 27744 1 363 . 1 . 1 43 43 VAL N N 15 121.607 0.30 . 1 . . . . . 40 VAL N . 27744 1 364 . 1 . 1 44 44 SER H H 1 8.721 0.03 . 1 . . . . . 41 SER H . 27744 1 365 . 1 . 1 44 44 SER HA H 1 4.710 0.03 . 1 . . . . . 41 SER HA . 27744 1 366 . 1 . 1 44 44 SER HB2 H 1 4.115 0.03 . 2 . . . . . 41 SER HB2 . 27744 1 367 . 1 . 1 44 44 SER HB3 H 1 4.366 0.03 . 2 . . . . . 41 SER HB3 . 27744 1 368 . 1 . 1 44 44 SER C C 13 170.361 0.30 . 1 . . . . . 41 SER C . 27744 1 369 . 1 . 1 44 44 SER CA C 13 58.230 0.01 . 1 . . . . . 41 SER CA . 27744 1 370 . 1 . 1 44 44 SER CB C 13 64.715 0.30 . 1 . . . . . 41 SER CB . 27744 1 371 . 1 . 1 44 44 SER N N 15 116.437 0.30 . 1 . . . . . 41 SER N . 27744 1 372 . 1 . 1 45 45 ILE H H 1 8.755 0.03 . 1 . . . . . 42 ILE H . 27744 1 373 . 1 . 1 45 45 ILE HA H 1 4.326 0.03 . 1 . . . . . 42 ILE HA . 27744 1 374 . 1 . 1 45 45 ILE HB H 1 2.020 0.03 . 1 . . . . . 42 ILE HB . 27744 1 375 . 1 . 1 45 45 ILE HD11 H 1 0.813 0.05 . 1 . . . . . 42 ILE HD11 . 27744 1 376 . 1 . 1 45 45 ILE HD12 H 1 0.813 0.05 . 1 . . . . . 42 ILE HD12 . 27744 1 377 . 1 . 1 45 45 ILE HD13 H 1 0.813 0.05 . 1 . . . . . 42 ILE HD13 . 27744 1 378 . 1 . 1 45 45 ILE C C 13 175.387 0.30 . 1 . . . . . 42 ILE C . 27744 1 379 . 1 . 1 45 45 ILE CA C 13 61.222 0.06 . 1 . . . . . 42 ILE CA . 27744 1 380 . 1 . 1 45 45 ILE CB C 13 37.891 0.30 . 1 . . . . . 42 ILE CB . 27744 1 381 . 1 . 1 45 45 ILE CD1 C 13 12.576 0.30 . 1 . . . . . 42 ILE CD1 . 27744 1 382 . 1 . 1 45 45 ILE N N 15 117.792 0.30 . 1 . . . . . 42 ILE N . 27744 1 383 . 1 . 1 46 46 ASP H H 1 7.782 0.03 . 1 . . . . . 43 ASP H . 27744 1 384 . 1 . 1 46 46 ASP HA H 1 4.552 0.03 . 1 . . . . . 43 ASP HA . 27744 1 385 . 1 . 1 46 46 ASP HB2 H 1 2.849 0.03 . 2 . . . . . 43 ASP HB2 . 27744 1 386 . 1 . 1 46 46 ASP HB3 H 1 2.849 0.03 . 2 . . . . . 43 ASP HB3 . 27744 1 387 . 1 . 1 46 46 ASP C C 13 178.914 0.30 . 1 . . . . . 43 ASP C . 27744 1 388 . 1 . 1 46 46 ASP CA C 13 57.163 0.06 . 1 . . . . . 43 ASP CA . 27744 1 389 . 1 . 1 46 46 ASP CB C 13 40.413 0.10 . 1 . . . . . 43 ASP CB . 27744 1 390 . 1 . 1 46 46 ASP N N 15 119.120 0.30 . 1 . . . . . 43 ASP N . 27744 1 391 . 1 . 1 47 47 GLU H H 1 7.631 0.03 . 1 . . . . . 44 GLU H . 27744 1 392 . 1 . 1 47 47 GLU HA H 1 4.268 0.03 . 1 . . . . . 44 GLU HA . 27744 1 393 . 1 . 1 47 47 GLU HB2 H 1 1.844 0.03 . 2 . . . . . 44 GLU HB2 . 27744 1 394 . 1 . 1 47 47 GLU HB3 H 1 2.046 0.03 . 2 . . . . . 44 GLU HB3 . 27744 1 395 . 1 . 1 47 47 GLU HG2 H 1 2.561 0.03 . 2 . . . . . 44 GLU HG2 . 27744 1 396 . 1 . 1 47 47 GLU HG3 H 1 2.561 0.03 . 2 . . . . . 44 GLU HG3 . 27744 1 397 . 1 . 1 47 47 GLU C C 13 177.520 0.30 . 1 . . . . . 44 GLU C . 27744 1 398 . 1 . 1 47 47 GLU CA C 13 58.324 0.30 . 1 . . . . . 44 GLU CA . 27744 1 399 . 1 . 1 47 47 GLU CB C 13 29.476 0.13 . 1 . . . . . 44 GLU CB . 27744 1 400 . 1 . 1 47 47 GLU N N 15 122.161 0.30 . 1 . . . . . 44 GLU N . 27744 1 401 . 1 . 1 48 48 ALA H H 1 8.163 0.01 . 1 . . . . . 45 ALA H . 27744 1 402 . 1 . 1 48 48 ALA HA H 1 4.151 0.03 . 1 . . . . . 45 ALA HA . 27744 1 403 . 1 . 1 48 48 ALA HB1 H 1 1.617 0.03 . 1 . . . . . 45 ALA HB1 . 27744 1 404 . 1 . 1 48 48 ALA HB2 H 1 1.617 0.03 . 1 . . . . . 45 ALA HB2 . 27744 1 405 . 1 . 1 48 48 ALA HB3 H 1 1.617 0.03 . 1 . . . . . 45 ALA HB3 . 27744 1 406 . 1 . 1 48 48 ALA C C 13 178.670 0.30 . 1 . . . . . 45 ALA C . 27744 1 407 . 1 . 1 48 48 ALA CA C 13 55.389 0.12 . 1 . . . . . 45 ALA CA . 27744 1 408 . 1 . 1 48 48 ALA CB C 13 19.340 0.06 . 1 . . . . . 45 ALA CB . 27744 1 409 . 1 . 1 48 48 ALA N N 15 122.042 0.30 . 1 . . . . . 45 ALA N . 27744 1 410 . 1 . 1 49 49 ILE H H 1 8.465 0.03 . 1 . . . . . 46 ILE H . 27744 1 411 . 1 . 1 49 49 ILE HA H 1 3.919 0.03 . 1 . . . . . 46 ILE HA . 27744 1 412 . 1 . 1 49 49 ILE HB H 1 2.212 0.03 . 1 . . . . . 46 ILE HB . 27744 1 413 . 1 . 1 49 49 ILE HD11 H 1 0.788 0.05 . 1 . . . . . 46 ILE HD11 . 27744 1 414 . 1 . 1 49 49 ILE HD12 H 1 0.788 0.05 . 1 . . . . . 46 ILE HD12 . 27744 1 415 . 1 . 1 49 49 ILE HD13 H 1 0.788 0.05 . 1 . . . . . 46 ILE HD13 . 27744 1 416 . 1 . 1 49 49 ILE HG12 H 1 1.178 0.05 . 2 . . . . . 46 ILE HG12 . 27744 1 417 . 1 . 1 49 49 ILE HG13 H 1 1.178 0.05 . 2 . . . . . 46 ILE HG13 . 27744 1 418 . 1 . 1 49 49 ILE HG21 H 1 0.903 0.05 . 1 . . . . . 46 ILE HG21 . 27744 1 419 . 1 . 1 49 49 ILE HG22 H 1 0.903 0.05 . 1 . . . . . 46 ILE HG22 . 27744 1 420 . 1 . 1 49 49 ILE HG23 H 1 0.903 0.05 . 1 . . . . . 46 ILE HG23 . 27744 1 421 . 1 . 1 49 49 ILE C C 13 177.886 0.30 . 1 . . . . . 46 ILE C . 27744 1 422 . 1 . 1 49 49 ILE CA C 13 64.322 0.36 . 1 . . . . . 46 ILE CA . 27744 1 423 . 1 . 1 49 49 ILE CB C 13 37.138 0.10 . 1 . . . . . 46 ILE CB . 27744 1 424 . 1 . 1 49 49 ILE CD1 C 13 14.567 0.10 . 1 . . . . . 46 ILE CD1 . 27744 1 425 . 1 . 1 49 49 ILE CG2 C 13 16.813 0.10 . 1 . . . . . 46 ILE CG2 . 27744 1 426 . 1 . 1 49 49 ILE N N 15 117.707 0.10 . 1 . . . . . 46 ILE N . 27744 1 427 . 1 . 1 50 50 ARG H H 1 7.729 0.01 . 1 . . . . . 47 ARG H . 27744 1 428 . 1 . 1 50 50 ARG HA H 1 4.235 0.03 . 1 . . . . . 47 ARG HA . 27744 1 429 . 1 . 1 50 50 ARG HB2 H 1 2.082 0.03 . 2 . . . . . 47 ARG HB2 . 27744 1 430 . 1 . 1 50 50 ARG HB3 H 1 1.957 0.03 . 2 . . . . . 47 ARG HB3 . 27744 1 431 . 1 . 1 50 50 ARG HD2 H 1 3.215 0.03 . 2 . . . . . 47 ARG HD2 . 27744 1 432 . 1 . 1 50 50 ARG HD3 H 1 3.215 0.03 . 2 . . . . . 47 ARG HD3 . 27744 1 433 . 1 . 1 50 50 ARG HG2 H 1 1.702 0.05 . 2 . . . . . 47 ARG HG2 . 27744 1 434 . 1 . 1 50 50 ARG HG3 H 1 1.703 0.05 . 2 . . . . . 47 ARG HG3 . 27744 1 435 . 1 . 1 50 50 ARG C C 13 179.632 0.30 . 1 . . . . . 47 ARG C . 27744 1 436 . 1 . 1 50 50 ARG CA C 13 59.914 0.10 . 1 . . . . . 47 ARG CA . 27744 1 437 . 1 . 1 50 50 ARG CB C 13 29.909 0.30 . 1 . . . . . 47 ARG CB . 27744 1 438 . 1 . 1 50 50 ARG N N 15 121.094 0.30 . 1 . . . . . 47 ARG N . 27744 1 439 . 1 . 1 51 51 LEU H H 1 8.416 0.03 . 1 . . . . . 48 LEU H . 27744 1 440 . 1 . 1 51 51 LEU HA H 1 4.232 0.03 . 1 . . . . . 48 LEU HA . 27744 1 441 . 1 . 1 51 51 LEU HB2 H 1 1.852 0.05 . 2 . . . . . 48 LEU HB2 . 27744 1 442 . 1 . 1 51 51 LEU HB3 H 1 1.852 0.05 . 2 . . . . . 48 LEU HB3 . 27744 1 443 . 1 . 1 51 51 LEU HD11 H 1 0.788 0.05 . 2 . . . . . 48 LEU HD11 . 27744 1 444 . 1 . 1 51 51 LEU HD12 H 1 0.788 0.05 . 2 . . . . . 48 LEU HD12 . 27744 1 445 . 1 . 1 51 51 LEU HD13 H 1 0.788 0.05 . 2 . . . . . 48 LEU HD13 . 27744 1 446 . 1 . 1 51 51 LEU HD21 H 1 0.831 0.05 . 2 . . . . . 48 LEU HD21 . 27744 1 447 . 1 . 1 51 51 LEU HD22 H 1 0.831 0.05 . 2 . . . . . 48 LEU HD22 . 27744 1 448 . 1 . 1 51 51 LEU HD23 H 1 0.831 0.05 . 2 . . . . . 48 LEU HD23 . 27744 1 449 . 1 . 1 51 51 LEU C C 13 180.386 0.30 . 1 . . . . . 48 LEU C . 27744 1 450 . 1 . 1 51 51 LEU CA C 13 57.922 0.10 . 1 . . . . . 48 LEU CA . 27744 1 451 . 1 . 1 51 51 LEU CB C 13 41.475 0.17 . 1 . . . . . 48 LEU CB . 27744 1 452 . 1 . 1 51 51 LEU CD1 C 13 26.668 0.30 . 1 . . . . . 48 LEU CD1 . 27744 1 453 . 1 . 1 51 51 LEU N N 15 120.039 0.30 . 1 . . . . . 48 LEU N . 27744 1 454 . 1 . 1 52 52 ALA H H 1 8.291 0.01 . 1 . . . . . 49 ALA H . 27744 1 455 . 1 . 1 52 52 ALA HA H 1 4.184 0.03 . 1 . . . . . 49 ALA HA . 27744 1 456 . 1 . 1 52 52 ALA HB1 H 1 1.695 0.03 . 1 . . . . . 49 ALA HB1 . 27744 1 457 . 1 . 1 52 52 ALA HB2 H 1 1.636 0.03 . 1 . . . . . 49 ALA HB2 . 27744 1 458 . 1 . 1 52 52 ALA HB3 H 1 1.646 0.03 . 1 . . . . . 49 ALA HB3 . 27744 1 459 . 1 . 1 52 52 ALA C C 13 178.932 0.30 . 1 . . . . . 49 ALA C . 27744 1 460 . 1 . 1 52 52 ALA CA C 13 56.099 0.10 . 1 . . . . . 49 ALA CA . 27744 1 461 . 1 . 1 52 52 ALA CB C 13 18.125 0.01 . 1 . . . . . 49 ALA CB . 27744 1 462 . 1 . 1 52 52 ALA N N 15 125.579 0.30 . 1 . . . . . 49 ALA N . 27744 1 463 . 1 . 1 53 53 GLU H H 1 8.683 0.03 . 1 . . . . . 50 GLU H . 27744 1 464 . 1 . 1 53 53 GLU HA H 1 4.154 0.03 . 1 . . . . . 50 GLU HA . 27744 1 465 . 1 . 1 53 53 GLU HB2 H 1 1.857 0.03 . 2 . . . . . 50 GLU HB2 . 27744 1 466 . 1 . 1 53 53 GLU HB3 H 1 2.306 0.03 . 2 . . . . . 50 GLU HB3 . 27744 1 467 . 1 . 1 53 53 GLU HG2 H 1 2.554 0.03 . 2 . . . . . 50 GLU HG2 . 27744 1 468 . 1 . 1 53 53 GLU HG3 H 1 2.554 0.03 . 2 . . . . . 50 GLU HG3 . 27744 1 469 . 1 . 1 53 53 GLU C C 13 176.279 0.30 . 1 . . . . . 50 GLU C . 27744 1 470 . 1 . 1 53 53 GLU CA C 13 59.540 0.15 . 1 . . . . . 50 GLU CA . 27744 1 471 . 1 . 1 53 53 GLU CB C 13 29.071 0.30 . 1 . . . . . 50 GLU CB . 27744 1 472 . 1 . 1 53 53 GLU N N 15 118.373 0.30 . 1 . . . . . 50 GLU N . 27744 1 473 . 1 . 1 54 54 GLU H H 1 8.532 0.03 . 1 . . . . . 51 GLU H . 27744 1 474 . 1 . 1 54 54 GLU HA H 1 4.047 0.03 . 1 . . . . . 51 GLU HA . 27744 1 475 . 1 . 1 54 54 GLU HB2 H 1 2.121 0.03 . 2 . . . . . 51 GLU HB2 . 27744 1 476 . 1 . 1 54 54 GLU HB3 H 1 2.232 0.03 . 2 . . . . . 51 GLU HB3 . 27744 1 477 . 1 . 1 54 54 GLU HG2 H 1 2.453 0.05 . 2 . . . . . 51 GLU HG2 . 27744 1 478 . 1 . 1 54 54 GLU HG3 H 1 2.453 0.05 . 2 . . . . . 51 GLU HG3 . 27744 1 479 . 1 . 1 54 54 GLU C C 13 177.933 0.30 . 1 . . . . . 51 GLU C . 27744 1 480 . 1 . 1 54 54 GLU CA C 13 59.414 0.14 . 1 . . . . . 51 GLU CA . 27744 1 481 . 1 . 1 54 54 GLU CB C 13 29.520 0.16 . 1 . . . . . 51 GLU CB . 27744 1 482 . 1 . 1 54 54 GLU N N 15 121.533 0.14 . 1 . . . . . 51 GLU N . 27744 1 483 . 1 . 1 55 55 ALA H H 1 7.438 0.03 . 1 . . . . . 52 ALA H . 27744 1 484 . 1 . 1 55 55 ALA HA H 1 4.485 0.03 . 1 . . . . . 52 ALA HA . 27744 1 485 . 1 . 1 55 55 ALA HB1 H 1 1.700 0.03 . 1 . . . . . 52 ALA HB1 . 27744 1 486 . 1 . 1 55 55 ALA HB2 H 1 1.659 0.03 . 1 . . . . . 52 ALA HB2 . 27744 1 487 . 1 . 1 55 55 ALA HB3 H 1 1.709 0.03 . 1 . . . . . 52 ALA HB3 . 27744 1 488 . 1 . 1 55 55 ALA C C 13 175.636 0.30 . 1 . . . . . 52 ALA C . 27744 1 489 . 1 . 1 55 55 ALA CA C 13 52.237 0.09 . 1 . . . . . 52 ALA CA . 27744 1 490 . 1 . 1 55 55 ALA CB C 13 19.109 0.01 . 1 . . . . . 52 ALA CB . 27744 1 491 . 1 . 1 55 55 ALA N N 15 119.701 0.30 . 1 . . . . . 52 ALA N . 27744 1 492 . 1 . 1 56 56 LYS H H 1 7.939 0.03 . 1 . . . . . 53 LYS H . 27744 1 493 . 1 . 1 56 56 LYS HA H 1 3.917 0.03 . 1 . . . . . 53 LYS HA . 27744 1 494 . 1 . 1 56 56 LYS HB2 H 1 1.922 0.03 . 2 . . . . . 53 LYS HB2 . 27744 1 495 . 1 . 1 56 56 LYS HB3 H 1 2.116 0.03 . 2 . . . . . 53 LYS HB3 . 27744 1 496 . 1 . 1 56 56 LYS HD2 H 1 1.662 0.03 . 2 . . . . . 53 LYS HD2 . 27744 1 497 . 1 . 1 56 56 LYS HD3 H 1 1.662 0.03 . 2 . . . . . 53 LYS HD3 . 27744 1 498 . 1 . 1 56 56 LYS HE2 H 1 3.057 0.03 . 2 . . . . . 53 LYS HE2 . 27744 1 499 . 1 . 1 56 56 LYS HE3 H 1 3.057 0.03 . 2 . . . . . 53 LYS HE3 . 27744 1 500 . 1 . 1 56 56 LYS HG2 H 1 1.466 0.03 . 2 . . . . . 53 LYS HG2 . 27744 1 501 . 1 . 1 56 56 LYS HG3 H 1 1.442 0.03 . 2 . . . . . 53 LYS HG3 . 27744 1 502 . 1 . 1 56 56 LYS C C 13 175.625 0.30 . 1 . . . . . 53 LYS C . 27744 1 503 . 1 . 1 56 56 LYS CA C 13 56.774 0.30 . 1 . . . . . 53 LYS CA . 27744 1 504 . 1 . 1 56 56 LYS CB C 13 28.812 0.32 . 1 . . . . . 53 LYS CB . 27744 1 505 . 1 . 1 56 56 LYS CD C 13 42.868 0.30 . 1 . . . . . 53 LYS CD . 27744 1 506 . 1 . 1 56 56 LYS N N 15 115.196 0.30 . 1 . . . . . 53 LYS N . 27744 1 507 . 1 . 1 57 57 LEU H H 1 7.841 0.03 . 1 . . . . . 54 LEU H . 27744 1 508 . 1 . 1 57 57 LEU HA H 1 5.151 0.03 . 1 . . . . . 54 LEU HA . 27744 1 509 . 1 . 1 57 57 LEU HB2 H 1 1.282 0.05 . 2 . . . . . 54 LEU HB2 . 27744 1 510 . 1 . 1 57 57 LEU HB3 H 1 1.466 0.05 . 2 . . . . . 54 LEU HB3 . 27744 1 511 . 1 . 1 57 57 LEU HD11 H 1 0.796 0.05 . 2 . . . . . 54 LEU HD11 . 27744 1 512 . 1 . 1 57 57 LEU HD12 H 1 0.796 0.05 . 2 . . . . . 54 LEU HD12 . 27744 1 513 . 1 . 1 57 57 LEU HD13 H 1 0.796 0.05 . 2 . . . . . 54 LEU HD13 . 27744 1 514 . 1 . 1 57 57 LEU HD21 H 1 0.929 0.05 . 2 . . . . . 54 LEU HD21 . 27744 1 515 . 1 . 1 57 57 LEU HD22 H 1 0.929 0.05 . 2 . . . . . 54 LEU HD22 . 27744 1 516 . 1 . 1 57 57 LEU HD23 H 1 0.929 0.05 . 2 . . . . . 54 LEU HD23 . 27744 1 517 . 1 . 1 57 57 LEU C C 13 174.898 0.30 . 1 . . . . . 54 LEU C . 27744 1 518 . 1 . 1 57 57 LEU CA C 13 52.792 0.30 . 1 . . . . . 54 LEU CA . 27744 1 519 . 1 . 1 57 57 LEU CB C 13 47.679 0.30 . 1 . . . . . 54 LEU CB . 27744 1 520 . 1 . 1 57 57 LEU CD1 C 13 27.856 0.30 . 1 . . . . . 54 LEU CD1 . 27744 1 521 . 1 . 1 57 57 LEU N N 15 119.523 0.30 . 1 . . . . . 54 LEU N . 27744 1 522 . 1 . 1 58 58 ASP H H 1 7.598 0.01 . 1 . . . . . 55 ASP H . 27744 1 523 . 1 . 1 58 58 ASP HA H 1 5.249 0.03 . 1 . . . . . 55 ASP HA . 27744 1 524 . 1 . 1 58 58 ASP C C 13 173.798 0.30 . 1 . . . . . 55 ASP C . 27744 1 525 . 1 . 1 58 58 ASP CA C 13 54.791 0.04 . 1 . . . . . 55 ASP CA . 27744 1 526 . 1 . 1 58 58 ASP CB C 13 44.203 0.30 . 1 . . . . . 55 ASP CB . 27744 1 527 . 1 . 1 58 58 ASP N N 15 115.976 0.30 . 1 . . . . . 55 ASP N . 27744 1 528 . 1 . 1 59 59 LEU H H 1 8.723 0.01 . 1 . . . . . 56 LEU H . 27744 1 529 . 1 . 1 59 59 LEU HA H 1 4.601 0.05 . 1 . . . . . 56 LEU HA . 27744 1 530 . 1 . 1 59 59 LEU HB2 H 1 1.424 0.05 . 2 . . . . . 56 LEU HB2 . 27744 1 531 . 1 . 1 59 59 LEU HB3 H 1 1.476 0.05 . 2 . . . . . 56 LEU HB3 . 27744 1 532 . 1 . 1 59 59 LEU HD11 H 1 0.740 0.05 . 2 . . . . . 56 LEU HD11 . 27744 1 533 . 1 . 1 59 59 LEU HD12 H 1 0.740 0.05 . 2 . . . . . 56 LEU HD12 . 27744 1 534 . 1 . 1 59 59 LEU HD13 H 1 0.740 0.05 . 2 . . . . . 56 LEU HD13 . 27744 1 535 . 1 . 1 59 59 LEU HD21 H 1 0.997 0.05 . 2 . . . . . 56 LEU HD21 . 27744 1 536 . 1 . 1 59 59 LEU HD22 H 1 0.997 0.05 . 2 . . . . . 56 LEU HD22 . 27744 1 537 . 1 . 1 59 59 LEU HD23 H 1 0.997 0.05 . 2 . . . . . 56 LEU HD23 . 27744 1 538 . 1 . 1 59 59 LEU HG H 1 1.439 0.05 . 1 . . . . . 56 LEU HG . 27744 1 539 . 1 . 1 59 59 LEU C C 13 174.958 0.30 . 1 . . . . . 56 LEU C . 27744 1 540 . 1 . 1 59 59 LEU CA C 13 53.422 0.30 . 1 . . . . . 56 LEU CA . 27744 1 541 . 1 . 1 59 59 LEU CB C 13 43.774 0.30 . 1 . . . . . 56 LEU CB . 27744 1 542 . 1 . 1 59 59 LEU N N 15 120.820 0.30 . 1 . . . . . 56 LEU N . 27744 1 543 . 1 . 1 60 60 VAL H H 1 8.716 0.03 . 1 . . . . . 57 VAL H . 27744 1 544 . 1 . 1 60 60 VAL HA H 1 4.698 0.03 . 1 . . . . . 57 VAL HA . 27744 1 545 . 1 . 1 60 60 VAL HB H 1 1.988 0.03 . 1 . . . . . 57 VAL HB . 27744 1 546 . 1 . 1 60 60 VAL HG11 H 1 0.668 0.03 . 2 . . . . . 57 VAL HG11 . 27744 1 547 . 1 . 1 60 60 VAL HG12 H 1 0.668 0.03 . 2 . . . . . 57 VAL HG12 . 27744 1 548 . 1 . 1 60 60 VAL HG13 H 1 0.668 0.03 . 2 . . . . . 57 VAL HG13 . 27744 1 549 . 1 . 1 60 60 VAL HG21 H 1 0.802 0.03 . 2 . . . . . 57 VAL HG21 . 27744 1 550 . 1 . 1 60 60 VAL HG22 H 1 0.802 0.03 . 2 . . . . . 57 VAL HG22 . 27744 1 551 . 1 . 1 60 60 VAL HG23 H 1 0.802 0.03 . 2 . . . . . 57 VAL HG23 . 27744 1 552 . 1 . 1 60 60 VAL C C 13 175.396 0.30 . 1 . . . . . 57 VAL C . 27744 1 553 . 1 . 1 60 60 VAL CA C 13 60.978 0.17 . 1 . . . . . 57 VAL CA . 27744 1 554 . 1 . 1 60 60 VAL CB C 13 34.784 0.30 . 1 . . . . . 57 VAL CB . 27744 1 555 . 1 . 1 60 60 VAL CG1 C 13 20.718 0.30 . 1 . . . . . 57 VAL CG1 . 27744 1 556 . 1 . 1 60 60 VAL CG2 C 13 22.013 0.30 . 1 . . . . . 57 VAL CG2 . 27744 1 557 . 1 . 1 60 60 VAL N N 15 126.040 0.30 . 1 . . . . . 57 VAL N . 27744 1 558 . 1 . 1 61 61 GLU H H 1 8.609 0.01 . 1 . . . . . 58 GLU H . 27744 1 559 . 1 . 1 61 61 GLU HA H 1 4.795 0.03 . 1 . . . . . 58 GLU HA . 27744 1 560 . 1 . 1 61 61 GLU HB2 H 1 1.999 0.03 . 2 . . . . . 58 GLU HB2 . 27744 1 561 . 1 . 1 61 61 GLU HB3 H 1 1.999 0.03 . 2 . . . . . 58 GLU HB3 . 27744 1 562 . 1 . 1 61 61 GLU HG2 H 1 2.265 0.03 . 2 . . . . . 58 GLU HG2 . 27744 1 563 . 1 . 1 61 61 GLU HG3 H 1 2.265 0.03 . 2 . . . . . 58 GLU HG3 . 27744 1 564 . 1 . 1 61 61 GLU C C 13 175.239 0.30 . 1 . . . . . 58 GLU C . 27744 1 565 . 1 . 1 61 61 GLU CA C 13 57.049 0.07 . 1 . . . . . 58 GLU CA . 27744 1 566 . 1 . 1 61 61 GLU CB C 13 30.515 0.09 . 1 . . . . . 58 GLU CB . 27744 1 567 . 1 . 1 61 61 GLU CG C 13 36.751 0.30 . 1 . . . . . 58 GLU CG . 27744 1 568 . 1 . 1 61 61 GLU N N 15 129.280 0.30 . 1 . . . . . 58 GLU N . 27744 1 569 . 1 . 1 62 62 ILE H H 1 8.795 0.01 . 1 . . . . . 59 ILE H . 27744 1 570 . 1 . 1 62 62 ILE HA H 1 4.705 0.03 . 1 . . . . . 59 ILE HA . 27744 1 571 . 1 . 1 62 62 ILE HB H 1 2.200 0.03 . 1 . . . . . 59 ILE HB . 27744 1 572 . 1 . 1 62 62 ILE HD11 H 1 0.729 0.03 . 1 . . . . . 59 ILE HD11 . 27744 1 573 . 1 . 1 62 62 ILE HD12 H 1 0.729 0.03 . 1 . . . . . 59 ILE HD12 . 27744 1 574 . 1 . 1 62 62 ILE HD13 H 1 0.729 0.03 . 1 . . . . . 59 ILE HD13 . 27744 1 575 . 1 . 1 62 62 ILE C C 13 177.007 0.30 . 1 . . . . . 59 ILE C . 27744 1 576 . 1 . 1 62 62 ILE CA C 13 61.391 0.12 . 1 . . . . . 59 ILE CA . 27744 1 577 . 1 . 1 62 62 ILE CB C 13 38.678 0.30 . 1 . . . . . 59 ILE CB . 27744 1 578 . 1 . 1 62 62 ILE CD1 C 13 12.678 0.30 . 1 . . . . . 59 ILE CD1 . 27744 1 579 . 1 . 1 62 62 ILE N N 15 125.093 0.30 . 1 . . . . . 59 ILE N . 27744 1 580 . 1 . 1 63 63 SER H H 1 7.692 0.03 . 1 . . . . . 60 SER H . 27744 1 581 . 1 . 1 63 63 SER HA H 1 5.073 0.03 . 1 . . . . . 60 SER HA . 27744 1 582 . 1 . 1 63 63 SER HB2 H 1 4.075 0.03 . 2 . . . . . 60 SER HB2 . 27744 1 583 . 1 . 1 63 63 SER HB3 H 1 4.080 0.03 . 2 . . . . . 60 SER HB3 . 27744 1 584 . 1 . 1 63 63 SER C C 13 173.992 0.30 . 1 . . . . . 60 SER C . 27744 1 585 . 1 . 1 63 63 SER CA C 13 57.222 0.30 . 1 . . . . . 60 SER CA . 27744 1 586 . 1 . 1 63 63 SER CB C 13 64.150 0.30 . 1 . . . . . 60 SER CB . 27744 1 587 . 1 . 1 63 63 SER N N 15 115.050 0.30 . 1 . . . . . 60 SER N . 27744 1 588 . 1 . 1 64 64 ALA H H 1 8.988 0.01 . 1 . . . . . 61 ALA H . 27744 1 589 . 1 . 1 64 64 ALA HA H 1 4.638 0.03 . 1 . . . . . 61 ALA HA . 27744 1 590 . 1 . 1 64 64 ALA HB1 H 1 1.639 0.03 . 1 . . . . . 61 ALA HB1 . 27744 1 591 . 1 . 1 64 64 ALA HB2 H 1 1.646 0.03 . 1 . . . . . 61 ALA HB2 . 27744 1 592 . 1 . 1 64 64 ALA HB3 H 1 1.633 0.03 . 1 . . . . . 61 ALA HB3 . 27744 1 593 . 1 . 1 64 64 ALA C C 13 177.516 0.30 . 1 . . . . . 61 ALA C . 27744 1 594 . 1 . 1 64 64 ALA CA C 13 53.220 0.30 . 1 . . . . . 61 ALA CA . 27744 1 595 . 1 . 1 64 64 ALA CB C 13 19.623 0.30 . 1 . . . . . 61 ALA CB . 27744 1 596 . 1 . 1 64 64 ALA N N 15 128.335 0.30 . 1 . . . . . 61 ALA N . 27744 1 597 . 1 . 1 65 65 ASP H H 1 8.383 0.03 . 1 . . . . . 62 ASP H . 27744 1 598 . 1 . 1 65 65 ASP HA H 1 4.828 0.03 . 1 . . . . . 62 ASP HA . 27744 1 599 . 1 . 1 65 65 ASP HB2 H 1 2.898 0.03 . 2 . . . . . 62 ASP HB2 . 27744 1 600 . 1 . 1 65 65 ASP HB3 H 1 2.926 0.03 . 2 . . . . . 62 ASP HB3 . 27744 1 601 . 1 . 1 65 65 ASP C C 13 175.684 0.30 . 1 . . . . . 62 ASP C . 27744 1 602 . 1 . 1 65 65 ASP CA C 13 54.070 0.14 . 1 . . . . . 62 ASP CA . 27744 1 603 . 1 . 1 65 65 ASP CB C 13 40.686 0.06 . 1 . . . . . 62 ASP CB . 27744 1 604 . 1 . 1 65 65 ASP N N 15 115.416 0.30 . 1 . . . . . 62 ASP N . 27744 1 605 . 1 . 1 66 66 ALA H H 1 6.925 0.03 . 1 . . . . . 63 ALA H . 27744 1 606 . 1 . 1 66 66 ALA HA H 1 4.549 0.03 . 1 . . . . . 63 ALA HA . 27744 1 607 . 1 . 1 66 66 ALA HB1 H 1 1.637 0.03 . 1 . . . . . 63 ALA HB1 . 27744 1 608 . 1 . 1 66 66 ALA HB2 H 1 1.646 0.03 . 1 . . . . . 63 ALA HB2 . 27744 1 609 . 1 . 1 66 66 ALA HB3 H 1 1.633 0.03 . 1 . . . . . 63 ALA HB3 . 27744 1 610 . 1 . 1 66 66 ALA C C 13 175.387 0.30 . 1 . . . . . 63 ALA C . 27744 1 611 . 1 . 1 66 66 ALA CA C 13 51.631 0.08 . 1 . . . . . 63 ALA CA . 27744 1 612 . 1 . 1 66 66 ALA CB C 13 20.781 0.30 . 1 . . . . . 63 ALA CB . 27744 1 613 . 1 . 1 66 66 ALA N N 15 122.710 0.30 . 1 . . . . . 63 ALA N . 27744 1 614 . 1 . 1 67 67 VAL H H 1 8.135 0.03 . 1 . . . . . 64 VAL H . 27744 1 615 . 1 . 1 67 67 VAL HA H 1 4.292 0.03 . 1 . . . . . 64 VAL HA . 27744 1 616 . 1 . 1 67 67 VAL HB H 1 1.981 0.03 . 1 . . . . . 64 VAL HB . 27744 1 617 . 1 . 1 67 67 VAL HG11 H 1 0.936 0.03 . 2 . . . . . 64 VAL HG11 . 27744 1 618 . 1 . 1 67 67 VAL HG12 H 1 0.936 0.03 . 2 . . . . . 64 VAL HG12 . 27744 1 619 . 1 . 1 67 67 VAL HG13 H 1 0.936 0.03 . 2 . . . . . 64 VAL HG13 . 27744 1 620 . 1 . 1 67 67 VAL HG21 H 1 0.921 0.03 . 2 . . . . . 64 VAL HG21 . 27744 1 621 . 1 . 1 67 67 VAL HG22 H 1 0.921 0.03 . 2 . . . . . 64 VAL HG22 . 27744 1 622 . 1 . 1 67 67 VAL HG23 H 1 0.921 0.03 . 2 . . . . . 64 VAL HG23 . 27744 1 623 . 1 . 1 67 67 VAL CA C 13 59.096 0.30 . 1 . . . . . 64 VAL CA . 27744 1 624 . 1 . 1 67 67 VAL CB C 13 33.781 0.30 . 1 . . . . . 64 VAL CB . 27744 1 625 . 1 . 1 67 67 VAL N N 15 119.168 0.30 . 1 . . . . . 64 VAL N . 27744 1 626 . 1 . 1 69 69 PRO HA H 1 4.613 0.03 . 1 . . . . . 66 PRO HA . 27744 1 627 . 1 . 1 69 69 PRO HB2 H 1 1.673 0.05 . 2 . . . . . 66 PRO HB2 . 27744 1 628 . 1 . 1 69 69 PRO HB3 H 1 1.684 0.05 . 2 . . . . . 66 PRO HB3 . 27744 1 629 . 1 . 1 69 69 PRO HG2 H 1 2.130 0.03 . 2 . . . . . 66 PRO HG2 . 27744 1 630 . 1 . 1 69 69 PRO HG3 H 1 2.130 0.03 . 2 . . . . . 66 PRO HG3 . 27744 1 631 . 1 . 1 69 69 PRO C C 13 175.671 0.30 . 1 . . . . . 66 PRO C . 27744 1 632 . 1 . 1 69 69 PRO CA C 13 63.761 0.30 . 1 . . . . . 66 PRO CA . 27744 1 633 . 1 . 1 69 69 PRO CB C 13 32.799 0.30 . 1 . . . . . 66 PRO CB . 27744 1 634 . 1 . 1 70 70 VAL H H 1 8.009 0.01 . 1 . . . . . 67 VAL H . 27744 1 635 . 1 . 1 70 70 VAL HA H 1 5.118 0.03 . 1 . . . . . 67 VAL HA . 27744 1 636 . 1 . 1 70 70 VAL HB H 1 2.273 0.03 . 1 . . . . . 67 VAL HB . 27744 1 637 . 1 . 1 70 70 VAL HG11 H 1 0.883 0.03 . 2 . . . . . 67 VAL HG11 . 27744 1 638 . 1 . 1 70 70 VAL HG12 H 1 0.883 0.03 . 2 . . . . . 67 VAL HG12 . 27744 1 639 . 1 . 1 70 70 VAL HG13 H 1 0.883 0.03 . 2 . . . . . 67 VAL HG13 . 27744 1 640 . 1 . 1 70 70 VAL HG21 H 1 1.011 0.03 . 2 . . . . . 67 VAL HG21 . 27744 1 641 . 1 . 1 70 70 VAL HG22 H 1 1.011 0.03 . 2 . . . . . 67 VAL HG22 . 27744 1 642 . 1 . 1 70 70 VAL HG23 H 1 1.011 0.03 . 2 . . . . . 67 VAL HG23 . 27744 1 643 . 1 . 1 70 70 VAL C C 13 177.209 0.30 . 1 . . . . . 67 VAL C . 27744 1 644 . 1 . 1 70 70 VAL CA C 13 61.673 0.30 . 1 . . . . . 67 VAL CA . 27744 1 645 . 1 . 1 70 70 VAL CB C 13 32.681 0.30 . 1 . . . . . 67 VAL CB . 27744 1 646 . 1 . 1 70 70 VAL CG2 C 13 21.493 0.30 . 1 . . . . . 67 VAL CG2 . 27744 1 647 . 1 . 1 70 70 VAL N N 15 120.916 0.30 . 1 . . . . . 67 VAL N . 27744 1 648 . 1 . 1 71 71 CYS H H 1 9.117 0.01 . 1 . . . . . 68 CYS H . 27744 1 649 . 1 . 1 71 71 CYS HA H 1 5.883 0.03 . 1 . . . . . 68 CYS HA . 27744 1 650 . 1 . 1 71 71 CYS HB2 H 1 2.666 0.03 . 2 . . . . . 68 CYS HB2 . 27744 1 651 . 1 . 1 71 71 CYS HB3 H 1 2.651 0.03 . 2 . . . . . 68 CYS HB3 . 27744 1 652 . 1 . 1 71 71 CYS C C 13 171.702 0.30 . 1 . . . . . 68 CYS C . 27744 1 653 . 1 . 1 71 71 CYS CA C 13 56.638 0.30 . 1 . . . . . 68 CYS CA . 27744 1 654 . 1 . 1 71 71 CYS CB C 13 32.850 0.13 . 1 . . . . . 68 CYS CB . 27744 1 655 . 1 . 1 71 71 CYS N N 15 123.560 0.30 . 1 . . . . . 68 CYS N . 27744 1 656 . 1 . 1 72 72 ARG H H 1 9.454 0.03 . 1 . . . . . 69 ARG H . 27744 1 657 . 1 . 1 72 72 ARG HA H 1 5.433 0.03 . 1 . . . . . 69 ARG HA . 27744 1 658 . 1 . 1 72 72 ARG HB2 H 1 1.321 0.03 . 2 . . . . . 69 ARG HB2 . 27744 1 659 . 1 . 1 72 72 ARG HB3 H 1 1.448 0.03 . 2 . . . . . 69 ARG HB3 . 27744 1 660 . 1 . 1 72 72 ARG HD2 H 1 3.067 0.03 . 2 . . . . . 69 ARG HD2 . 27744 1 661 . 1 . 1 72 72 ARG HD3 H 1 3.067 0.03 . 2 . . . . . 69 ARG HD3 . 27744 1 662 . 1 . 1 72 72 ARG HG2 H 1 1.517 0.03 . 2 . . . . . 69 ARG HG2 . 27744 1 663 . 1 . 1 72 72 ARG HG3 H 1 1.614 0.03 . 2 . . . . . 69 ARG HG3 . 27744 1 664 . 1 . 1 72 72 ARG C C 13 174.806 0.30 . 1 . . . . . 69 ARG C . 27744 1 665 . 1 . 1 72 72 ARG CA C 13 53.702 0.05 . 1 . . . . . 69 ARG CA . 27744 1 666 . 1 . 1 72 72 ARG CB C 13 35.728 0.06 . 1 . . . . . 69 ARG CB . 27744 1 667 . 1 . 1 72 72 ARG CD C 13 43.807 0.05 . 1 . . . . . 69 ARG CD . 27744 1 668 . 1 . 1 72 72 ARG CG C 13 27.909 0.06 . 1 . . . . . 69 ARG CG . 27744 1 669 . 1 . 1 72 72 ARG N N 15 122.204 0.30 . 1 . . . . . 69 ARG N . 27744 1 670 . 1 . 1 73 73 ILE H H 1 7.673 0.01 . 1 . . . . . 70 ILE H . 27744 1 671 . 1 . 1 73 73 ILE HA H 1 5.359 0.03 . 1 . . . . . 70 ILE HA . 27744 1 672 . 1 . 1 73 73 ILE HB H 1 1.779 0.03 . 1 . . . . . 70 ILE HB . 27744 1 673 . 1 . 1 73 73 ILE HD11 H 1 0.867 0.05 . 1 . . . . . 70 ILE HD11 . 27744 1 674 . 1 . 1 73 73 ILE HD12 H 1 0.867 0.05 . 1 . . . . . 70 ILE HD12 . 27744 1 675 . 1 . 1 73 73 ILE HD13 H 1 0.867 0.05 . 1 . . . . . 70 ILE HD13 . 27744 1 676 . 1 . 1 73 73 ILE HG21 H 1 0.887 0.05 . 1 . . . . . 70 ILE HG21 . 27744 1 677 . 1 . 1 73 73 ILE HG22 H 1 0.887 0.05 . 1 . . . . . 70 ILE HG22 . 27744 1 678 . 1 . 1 73 73 ILE HG23 H 1 0.887 0.05 . 1 . . . . . 70 ILE HG23 . 27744 1 679 . 1 . 1 73 73 ILE C C 13 174.769 0.30 . 1 . . . . . 70 ILE C . 27744 1 680 . 1 . 1 73 73 ILE CA C 13 60.912 0.09 . 1 . . . . . 70 ILE CA . 27744 1 681 . 1 . 1 73 73 ILE CB C 13 38.104 0.30 . 1 . . . . . 70 ILE CB . 27744 1 682 . 1 . 1 73 73 ILE CD1 C 13 13.547 0.30 . 1 . . . . . 70 ILE CD1 . 27744 1 683 . 1 . 1 73 73 ILE CG2 C 13 19.539 0.30 . 1 . . . . . 70 ILE CG2 . 27744 1 684 . 1 . 1 73 73 ILE N N 15 126.491 0.30 . 1 . . . . . 70 ILE N . 27744 1 685 . 1 . 1 74 74 MET H H 1 9.245 0.01 . 1 . . . . . 71 MET H . 27744 1 686 . 1 . 1 74 74 MET HA H 1 5.004 0.03 . 1 . . . . . 71 MET HA . 27744 1 687 . 1 . 1 74 74 MET HB2 H 1 2.334 0.03 . 2 . . . . . 71 MET HB2 . 27744 1 688 . 1 . 1 74 74 MET HB3 H 1 2.356 0.03 . 2 . . . . . 71 MET HB3 . 27744 1 689 . 1 . 1 74 74 MET HE1 H 1 2.120 0.03 . 1 . . . . . 71 MET HE1 . 27744 1 690 . 1 . 1 74 74 MET HE2 H 1 2.120 0.03 . 1 . . . . . 71 MET HE2 . 27744 1 691 . 1 . 1 74 74 MET HE3 H 1 2.120 0.03 . 1 . . . . . 71 MET HE3 . 27744 1 692 . 1 . 1 74 74 MET HG2 H 1 2.229 0.03 . 2 . . . . . 71 MET HG2 . 27744 1 693 . 1 . 1 74 74 MET HG3 H 1 2.229 0.03 . 2 . . . . . 71 MET HG3 . 27744 1 694 . 1 . 1 74 74 MET C C 13 172.710 0.30 . 1 . . . . . 71 MET C . 27744 1 695 . 1 . 1 74 74 MET CA C 13 55.378 0.06 . 1 . . . . . 71 MET CA . 27744 1 696 . 1 . 1 74 74 MET CB C 13 35.145 0.30 . 1 . . . . . 71 MET CB . 27744 1 697 . 1 . 1 74 74 MET CE C 13 16.639 0.30 . 1 . . . . . 71 MET CE . 27744 1 698 . 1 . 1 74 74 MET CG C 13 29.817 0.30 . 1 . . . . . 71 MET CG . 27744 1 699 . 1 . 1 74 74 MET N N 15 123.552 0.30 . 1 . . . . . 71 MET N . 27744 1 700 . 1 . 1 75 75 ASP H H 1 8.920 0.01 . 1 . . . . . 72 ASP H . 27744 1 701 . 1 . 1 75 75 ASP HA H 1 5.158 0.03 . 1 . . . . . 72 ASP HA . 27744 1 702 . 1 . 1 75 75 ASP HB2 H 1 2.801 0.03 . 2 . . . . . 72 ASP HB2 . 27744 1 703 . 1 . 1 75 75 ASP HB3 H 1 2.799 0.03 . 2 . . . . . 72 ASP HB3 . 27744 1 704 . 1 . 1 75 75 ASP C C 13 176.624 0.30 . 1 . . . . . 72 ASP C . 27744 1 705 . 1 . 1 75 75 ASP CA C 13 53.190 0.30 . 1 . . . . . 72 ASP CA . 27744 1 706 . 1 . 1 75 75 ASP CB C 13 40.983 0.15 . 1 . . . . . 72 ASP CB . 27744 1 707 . 1 . 1 75 75 ASP N N 15 121.161 0.30 . 1 . . . . . 72 ASP N . 27744 1 708 . 1 . 1 76 76 TYR H H 1 9.893 0.01 . 1 . . . . . 73 TYR H . 27744 1 709 . 1 . 1 76 76 TYR HA H 1 4.512 0.03 . 1 . . . . . 73 TYR HA . 27744 1 710 . 1 . 1 76 76 TYR HB2 H 1 2.904 0.03 . 2 . . . . . 73 TYR HB2 . 27744 1 711 . 1 . 1 76 76 TYR HB3 H 1 2.904 0.03 . 2 . . . . . 73 TYR HB3 . 27744 1 712 . 1 . 1 76 76 TYR HD1 H 1 7.561 0.03 . 3 . . . . . 73 TYR HD1 . 27744 1 713 . 1 . 1 76 76 TYR HD2 H 1 7.561 0.03 . 3 . . . . . 73 TYR HD2 . 27744 1 714 . 1 . 1 76 76 TYR HE1 H 1 7.039 0.03 . 3 . . . . . 73 TYR HE1 . 27744 1 715 . 1 . 1 76 76 TYR HE2 H 1 7.039 0.03 . 3 . . . . . 73 TYR HE2 . 27744 1 716 . 1 . 1 76 76 TYR C C 13 176.670 0.30 . 1 . . . . . 73 TYR C . 27744 1 717 . 1 . 1 76 76 TYR CA C 13 61.602 0.30 . 1 . . . . . 73 TYR CA . 27744 1 718 . 1 . 1 76 76 TYR CB C 13 38.860 0.30 . 1 . . . . . 73 TYR CB . 27744 1 719 . 1 . 1 76 76 TYR N N 15 130.742 0.10 . 1 . . . . . 73 TYR N . 27744 1 720 . 1 . 1 77 77 GLY H H 1 8.641 0.03 . 1 . . . . . 74 GLY H . 27744 1 721 . 1 . 1 77 77 GLY HA2 H 1 3.914 0.03 . 2 . . . . . 74 GLY HA2 . 27744 1 722 . 1 . 1 77 77 GLY HA3 H 1 4.118 0.03 . 2 . . . . . 74 GLY HA3 . 27744 1 723 . 1 . 1 77 77 GLY C C 13 176.634 0.30 . 1 . . . . . 74 GLY C . 27744 1 724 . 1 . 1 77 77 GLY CA C 13 46.877 0.16 . 1 . . . . . 74 GLY CA . 27744 1 725 . 1 . 1 77 77 GLY N N 15 106.873 0.30 . 1 . . . . . 74 GLY N . 27744 1 726 . 1 . 1 78 78 LYS H H 1 7.982 0.03 . 1 . . . . . 75 LYS H . 27744 1 727 . 1 . 1 78 78 LYS HA H 1 4.137 0.05 . 1 . . . . . 75 LYS HA . 27744 1 728 . 1 . 1 78 78 LYS HB2 H 1 1.780 0.03 . 2 . . . . . 75 LYS HB2 . 27744 1 729 . 1 . 1 78 78 LYS HB3 H 1 1.871 0.03 . 2 . . . . . 75 LYS HB3 . 27744 1 730 . 1 . 1 78 78 LYS HD2 H 1 1.746 0.03 . 2 . . . . . 75 LYS HD2 . 27744 1 731 . 1 . 1 78 78 LYS HD3 H 1 1.746 0.03 . 2 . . . . . 75 LYS HD3 . 27744 1 732 . 1 . 1 78 78 LYS HE2 H 1 2.962 0.03 . 2 . . . . . 75 LYS HE2 . 27744 1 733 . 1 . 1 78 78 LYS HE3 H 1 2.962 0.03 . 2 . . . . . 75 LYS HE3 . 27744 1 734 . 1 . 1 78 78 LYS HG2 H 1 1.414 0.03 . 2 . . . . . 75 LYS HG2 . 27744 1 735 . 1 . 1 78 78 LYS HG3 H 1 1.414 0.03 . 2 . . . . . 75 LYS HG3 . 27744 1 736 . 1 . 1 78 78 LYS C C 13 178.051 0.30 . 1 . . . . . 75 LYS C . 27744 1 737 . 1 . 1 78 78 LYS CA C 13 58.608 0.05 . 1 . . . . . 75 LYS CA . 27744 1 738 . 1 . 1 78 78 LYS CB C 13 32.435 0.06 . 1 . . . . . 75 LYS CB . 27744 1 739 . 1 . 1 78 78 LYS N N 15 122.245 0.30 . 1 . . . . . 75 LYS N . 27744 1 740 . 1 . 1 79 79 HIS H H 1 7.898 0.03 . 1 . . . . . 76 HIS H . 27744 1 741 . 1 . 1 79 79 HIS HA H 1 4.356 0.03 . 1 . . . . . 76 HIS HA . 27744 1 742 . 1 . 1 79 79 HIS HB2 H 1 3.070 0.03 . 2 . . . . . 76 HIS HB2 . 27744 1 743 . 1 . 1 79 79 HIS HB3 H 1 3.334 0.03 . 2 . . . . . 76 HIS HB3 . 27744 1 744 . 1 . 1 79 79 HIS HD2 H 1 6.710 0.03 . 1 . . . . . 76 HIS HD2 . 27744 1 745 . 1 . 1 79 79 HIS C C 13 176.765 0.30 . 1 . . . . . 76 HIS C . 27744 1 746 . 1 . 1 79 79 HIS CA C 13 58.714 0.04 . 1 . . . . . 76 HIS CA . 27744 1 747 . 1 . 1 79 79 HIS CB C 13 29.627 0.09 . 1 . . . . . 76 HIS CB . 27744 1 748 . 1 . 1 79 79 HIS N N 15 120.018 0.30 . 1 . . . . . 76 HIS N . 27744 1 749 . 1 . 1 80 80 LEU H H 1 8.101 0.01 . 1 . . . . . 77 LEU H . 27744 1 750 . 1 . 1 80 80 LEU HA H 1 4.032 0.03 . 1 . . . . . 77 LEU HA . 27744 1 751 . 1 . 1 80 80 LEU HB2 H 1 1.288 0.05 . 2 . . . . . 77 LEU HB2 . 27744 1 752 . 1 . 1 80 80 LEU HB3 H 1 1.537 0.05 . 2 . . . . . 77 LEU HB3 . 27744 1 753 . 1 . 1 80 80 LEU HD11 H 1 0.728 0.05 . 2 . . . . . 77 LEU HD11 . 27744 1 754 . 1 . 1 80 80 LEU HD12 H 1 0.728 0.05 . 2 . . . . . 77 LEU HD12 . 27744 1 755 . 1 . 1 80 80 LEU HD13 H 1 0.728 0.05 . 2 . . . . . 77 LEU HD13 . 27744 1 756 . 1 . 1 80 80 LEU HD21 H 1 0.698 0.05 . 2 . . . . . 77 LEU HD21 . 27744 1 757 . 1 . 1 80 80 LEU HD22 H 1 0.698 0.05 . 2 . . . . . 77 LEU HD22 . 27744 1 758 . 1 . 1 80 80 LEU HD23 H 1 0.698 0.05 . 2 . . . . . 77 LEU HD23 . 27744 1 759 . 1 . 1 80 80 LEU HG H 1 1.208 0.05 . 1 . . . . . 77 LEU HG . 27744 1 760 . 1 . 1 80 80 LEU C C 13 178.908 0.30 . 1 . . . . . 77 LEU C . 27744 1 761 . 1 . 1 80 80 LEU CA C 13 56.990 0.30 . 1 . . . . . 77 LEU CA . 27744 1 762 . 1 . 1 80 80 LEU CB C 13 41.775 0.30 . 1 . . . . . 77 LEU CB . 27744 1 763 . 1 . 1 80 80 LEU CD1 C 13 25.058 0.30 . 1 . . . . . 77 LEU CD1 . 27744 1 764 . 1 . 1 80 80 LEU CD2 C 13 22.749 0.30 . 1 . . . . . 77 LEU CD2 . 27744 1 765 . 1 . 1 80 80 LEU N N 15 119.214 0.30 . 1 . . . . . 77 LEU N . 27744 1 766 . 1 . 1 81 81 PHE H H 1 7.930 0.03 . 1 . . . . . 78 PHE H . 27744 1 767 . 1 . 1 81 81 PHE HA H 1 4.531 0.03 . 1 . . . . . 78 PHE HA . 27744 1 768 . 1 . 1 81 81 PHE HB2 H 1 3.441 0.03 . 2 . . . . . 78 PHE HB2 . 27744 1 769 . 1 . 1 81 81 PHE HB3 H 1 3.497 0.03 . 2 . . . . . 78 PHE HB3 . 27744 1 770 . 1 . 1 81 81 PHE HD1 H 1 7.252 0.05 . 3 . . . . . 78 PHE HD1 . 27744 1 771 . 1 . 1 81 81 PHE HD2 H 1 7.252 0.05 . 3 . . . . . 78 PHE HD2 . 27744 1 772 . 1 . 1 81 81 PHE C C 13 177.324 0.30 . 1 . . . . . 78 PHE C . 27744 1 773 . 1 . 1 81 81 PHE CA C 13 60.231 0.30 . 1 . . . . . 78 PHE CA . 27744 1 774 . 1 . 1 81 81 PHE CB C 13 39.275 0.08 . 1 . . . . . 78 PHE CB . 27744 1 775 . 1 . 1 81 81 PHE N N 15 119.912 0.30 . 1 . . . . . 78 PHE N . 27744 1 776 . 1 . 1 82 82 GLU H H 1 8.218 0.03 . 1 . . . . . 79 GLU H . 27744 1 777 . 1 . 1 82 82 GLU HA H 1 3.975 0.03 . 1 . . . . . 79 GLU HA . 27744 1 778 . 1 . 1 82 82 GLU HB2 H 1 2.069 0.03 . 2 . . . . . 79 GLU HB2 . 27744 1 779 . 1 . 1 82 82 GLU HB3 H 1 2.044 0.03 . 2 . . . . . 79 GLU HB3 . 27744 1 780 . 1 . 1 82 82 GLU HG2 H 1 2.364 0.03 . 2 . . . . . 79 GLU HG2 . 27744 1 781 . 1 . 1 82 82 GLU HG3 H 1 2.424 0.03 . 2 . . . . . 79 GLU HG3 . 27744 1 782 . 1 . 1 82 82 GLU C C 13 178.214 0.30 . 1 . . . . . 79 GLU C . 27744 1 783 . 1 . 1 82 82 GLU CA C 13 58.294 0.30 . 1 . . . . . 79 GLU CA . 27744 1 784 . 1 . 1 82 82 GLU CB C 13 29.532 0.09 . 1 . . . . . 79 GLU CB . 27744 1 785 . 1 . 1 82 82 GLU CG C 13 36.471 0.30 . 1 . . . . . 79 GLU CG . 27744 1 786 . 1 . 1 82 82 GLU N N 15 120.068 0.30 . 1 . . . . . 79 GLU N . 27744 1 787 . 1 . 1 83 83 LYS H H 1 8.079 0.03 . 1 . . . . . 80 LYS H . 27744 1 788 . 1 . 1 83 83 LYS HA H 1 4.108 0.03 . 1 . . . . . 80 LYS HA . 27744 1 789 . 1 . 1 83 83 LYS HB2 H 1 1.799 0.03 . 2 . . . . . 80 LYS HB2 . 27744 1 790 . 1 . 1 83 83 LYS HB3 H 1 1.799 0.03 . 2 . . . . . 80 LYS HB3 . 27744 1 791 . 1 . 1 83 83 LYS C C 13 178.049 0.30 . 1 . . . . . 80 LYS C . 27744 1 792 . 1 . 1 83 83 LYS CA C 13 58.108 0.07 . 1 . . . . . 80 LYS CA . 27744 1 793 . 1 . 1 83 83 LYS CB C 13 32.195 0.30 . 1 . . . . . 80 LYS CB . 27744 1 794 . 1 . 1 83 83 LYS N N 15 120.581 0.30 . 1 . . . . . 80 LYS N . 27744 1 795 . 1 . 1 84 84 LYS H H 1 7.958 0.03 . 1 . . . . . 81 LYS H . 27744 1 796 . 1 . 1 84 84 LYS HA H 1 4.068 0.03 . 1 . . . . . 81 LYS HA . 27744 1 797 . 1 . 1 84 84 LYS HB2 H 1 1.711 0.03 . 2 . . . . . 81 LYS HB2 . 27744 1 798 . 1 . 1 84 84 LYS HB3 H 1 1.711 0.03 . 2 . . . . . 81 LYS HB3 . 27744 1 799 . 1 . 1 84 84 LYS C C 13 178.394 0.30 . 1 . . . . . 81 LYS C . 27744 1 800 . 1 . 1 84 84 LYS CA C 13 57.935 0.18 . 1 . . . . . 81 LYS CA . 27744 1 801 . 1 . 1 84 84 LYS CB C 13 32.210 0.30 . 1 . . . . . 81 LYS CB . 27744 1 802 . 1 . 1 84 84 LYS N N 15 121.377 0.30 . 1 . . . . . 81 LYS N . 27744 1 803 . 1 . 1 85 85 LYS H H 1 7.948 0.03 . 1 . . . . . 82 LYS H . 27744 1 804 . 1 . 1 85 85 LYS HA H 1 4.060 0.03 . 1 . . . . . 82 LYS HA . 27744 1 805 . 1 . 1 85 85 LYS HB2 H 1 1.742 0.03 . 2 . . . . . 82 LYS HB2 . 27744 1 806 . 1 . 1 85 85 LYS HB3 H 1 1.742 0.03 . 2 . . . . . 82 LYS HB3 . 27744 1 807 . 1 . 1 85 85 LYS C C 13 177.810 0.30 . 1 . . . . . 82 LYS C . 27744 1 808 . 1 . 1 85 85 LYS CA C 13 57.920 0.10 . 1 . . . . . 82 LYS CA . 27744 1 809 . 1 . 1 85 85 LYS CB C 13 32.351 0.30 . 1 . . . . . 82 LYS CB . 27744 1 810 . 1 . 1 85 85 LYS N N 15 120.928 0.30 . 1 . . . . . 82 LYS N . 27744 1 811 . 1 . 1 86 86 GLN H H 1 8.144 0.03 . 1 . . . . . 83 GLN H . 27744 1 812 . 1 . 1 86 86 GLN HA H 1 4.152 0.03 . 1 . . . . . 83 GLN HA . 27744 1 813 . 1 . 1 86 86 GLN HB2 H 1 2.059 0.03 . 2 . . . . . 83 GLN HB2 . 27744 1 814 . 1 . 1 86 86 GLN HB3 H 1 2.065 0.03 . 2 . . . . . 83 GLN HB3 . 27744 1 815 . 1 . 1 86 86 GLN HG2 H 1 2.425 0.03 . 2 . . . . . 83 GLN HG2 . 27744 1 816 . 1 . 1 86 86 GLN HG3 H 1 2.387 0.03 . 2 . . . . . 83 GLN HG3 . 27744 1 817 . 1 . 1 86 86 GLN C C 13 176.950 0.30 . 1 . . . . . 83 GLN C . 27744 1 818 . 1 . 1 86 86 GLN CA C 13 56.918 0.30 . 1 . . . . . 83 GLN CA . 27744 1 819 . 1 . 1 86 86 GLN CB C 13 28.791 0.30 . 1 . . . . . 83 GLN CB . 27744 1 820 . 1 . 1 86 86 GLN CG C 13 33.733 0.30 . 1 . . . . . 83 GLN CG . 27744 1 821 . 1 . 1 86 86 GLN N N 15 119.683 0.30 . 1 . . . . . 83 GLN N . 27744 1 822 . 1 . 1 87 87 ALA H H 1 8.060 0.03 . 1 . . . . . 84 ALA H . 27744 1 823 . 1 . 1 87 87 ALA HA H 1 4.486 0.03 . 1 . . . . . 84 ALA HA . 27744 1 824 . 1 . 1 87 87 ALA HB1 H 1 1.658 0.03 . 1 . . . . . 84 ALA HB1 . 27744 1 825 . 1 . 1 87 87 ALA HB2 H 1 1.671 0.03 . 1 . . . . . 84 ALA HB2 . 27744 1 826 . 1 . 1 87 87 ALA HB3 H 1 1.671 0.03 . 1 . . . . . 84 ALA HB3 . 27744 1 827 . 1 . 1 87 87 ALA C C 13 178.249 0.30 . 1 . . . . . 84 ALA C . 27744 1 828 . 1 . 1 87 87 ALA CA C 13 53.230 0.30 . 1 . . . . . 84 ALA CA . 27744 1 829 . 1 . 1 87 87 ALA CB C 13 18.781 0.30 . 1 . . . . . 84 ALA CB . 27744 1 830 . 1 . 1 87 87 ALA N N 15 123.778 0.30 . 1 . . . . . 84 ALA N . 27744 1 831 . 1 . 1 88 88 ALA H H 1 7.974 0.03 . 1 . . . . . 85 ALA H . 27744 1 832 . 1 . 1 88 88 ALA HA H 1 4.521 0.03 . 1 . . . . . 85 ALA HA . 27744 1 833 . 1 . 1 88 88 ALA HB1 H 1 1.658 0.03 . 1 . . . . . 85 ALA HB1 . 27744 1 834 . 1 . 1 88 88 ALA HB2 H 1 1.659 0.03 . 1 . . . . . 85 ALA HB2 . 27744 1 835 . 1 . 1 88 88 ALA HB3 H 1 1.659 0.03 . 1 . . . . . 85 ALA HB3 . 27744 1 836 . 1 . 1 88 88 ALA C C 13 178.635 0.30 . 1 . . . . . 85 ALA C . 27744 1 837 . 1 . 1 88 88 ALA CA C 13 53.207 0.30 . 1 . . . . . 85 ALA CA . 27744 1 838 . 1 . 1 88 88 ALA CB C 13 18.820 0.30 . 1 . . . . . 85 ALA CB . 27744 1 839 . 1 . 1 88 88 ALA N N 15 122.307 0.30 . 1 . . . . . 85 ALA N . 27744 1 840 . 1 . 1 89 89 VAL H H 1 7.899 0.03 . 1 . . . . . 86 VAL H . 27744 1 841 . 1 . 1 89 89 VAL HA H 1 4.219 0.03 . 1 . . . . . 86 VAL HA . 27744 1 842 . 1 . 1 89 89 VAL HB H 1 2.338 0.03 . 1 . . . . . 86 VAL HB . 27744 1 843 . 1 . 1 89 89 VAL HG11 H 1 0.930 0.03 . 2 . . . . . 86 VAL HG11 . 27744 1 844 . 1 . 1 89 89 VAL HG12 H 1 0.930 0.03 . 2 . . . . . 86 VAL HG12 . 27744 1 845 . 1 . 1 89 89 VAL HG13 H 1 0.930 0.03 . 2 . . . . . 86 VAL HG13 . 27744 1 846 . 1 . 1 89 89 VAL HG21 H 1 0.959 0.03 . 2 . . . . . 86 VAL HG21 . 27744 1 847 . 1 . 1 89 89 VAL HG22 H 1 0.959 0.03 . 2 . . . . . 86 VAL HG22 . 27744 1 848 . 1 . 1 89 89 VAL HG23 H 1 0.959 0.03 . 2 . . . . . 86 VAL HG23 . 27744 1 849 . 1 . 1 89 89 VAL C C 13 176.519 0.30 . 1 . . . . . 86 VAL C . 27744 1 850 . 1 . 1 89 89 VAL CA C 13 63.163 0.11 . 1 . . . . . 86 VAL CA . 27744 1 851 . 1 . 1 89 89 VAL CB C 13 32.438 0.30 . 1 . . . . . 86 VAL CB . 27744 1 852 . 1 . 1 89 89 VAL CG2 C 13 21.004 0.30 . 1 . . . . . 86 VAL CG2 . 27744 1 853 . 1 . 1 89 89 VAL N N 15 118.975 0.30 . 1 . . . . . 86 VAL N . 27744 1 854 . 1 . 1 90 90 ALA H H 1 8.147 0.03 . 1 . . . . . 87 ALA H . 27744 1 855 . 1 . 1 90 90 ALA HA H 1 4.525 0.03 . 1 . . . . . 87 ALA HA . 27744 1 856 . 1 . 1 90 90 ALA HB1 H 1 1.648 0.03 . 1 . . . . . 87 ALA HB1 . 27744 1 857 . 1 . 1 90 90 ALA HB2 H 1 1.652 0.03 . 1 . . . . . 87 ALA HB2 . 27744 1 858 . 1 . 1 90 90 ALA HB3 H 1 1.649 0.03 . 1 . . . . . 87 ALA HB3 . 27744 1 859 . 1 . 1 90 90 ALA C C 13 178.273 0.30 . 1 . . . . . 87 ALA C . 27744 1 860 . 1 . 1 90 90 ALA CA C 13 53.055 0.30 . 1 . . . . . 87 ALA CA . 27744 1 861 . 1 . 1 90 90 ALA CB C 13 18.936 0.30 . 1 . . . . . 87 ALA CB . 27744 1 862 . 1 . 1 90 90 ALA N N 15 126.326 0.30 . 1 . . . . . 87 ALA N . 27744 1 863 . 1 . 1 91 91 LYS H H 1 8.117 0.03 . 1 . . . . . 88 LYS H . 27744 1 864 . 1 . 1 91 91 LYS CA C 13 56.833 0.30 . 1 . . . . . 88 LYS CA . 27744 1 865 . 1 . 1 91 91 LYS CB C 13 32.740 0.30 . 1 . . . . . 88 LYS CB . 27744 1 866 . 1 . 1 91 91 LYS N N 15 120.148 0.30 . 1 . . . . . 88 LYS N . 27744 1 867 . 1 . 1 92 92 LYS H H 1 7.797 0.03 . 1 . . . . . 89 LYS H . 27744 1 868 . 1 . 1 92 92 LYS HA H 1 4.270 0.03 . 1 . . . . . 89 LYS HA . 27744 1 869 . 1 . 1 92 92 LYS HB2 H 1 2.058 0.03 . 1 . . . . . 89 LYS HB2 . 27744 1 870 . 1 . 1 92 92 LYS HB3 H 1 2.058 0.03 . 1 . . . . . 89 LYS HB3 . 27744 1 871 . 1 . 1 92 92 LYS C C 13 176.067 0.30 . 1 . . . . . 89 LYS C . 27744 1 872 . 1 . 1 92 92 LYS CA C 13 58.405 0.30 . 1 . . . . . 89 LYS CA . 27744 1 873 . 1 . 1 92 92 LYS CB C 13 28.154 0.30 . 1 . . . . . 89 LYS CB . 27744 1 874 . 1 . 1 92 92 LYS N N 15 124.015 0.30 . 1 . . . . . 89 LYS N . 27744 1 875 . 1 . 1 93 93 ASN H H 1 8.557 0.03 . 1 . . . . . 90 ASN H . 27744 1 876 . 1 . 1 93 93 ASN HA H 1 4.924 0.03 . 1 . . . . . 90 ASN HA . 27744 1 877 . 1 . 1 93 93 ASN HB2 H 1 3.056 0.03 . 2 . . . . . 90 ASN HB2 . 27744 1 878 . 1 . 1 93 93 ASN HB3 H 1 3.056 0.03 . 2 . . . . . 90 ASN HB3 . 27744 1 879 . 1 . 1 93 93 ASN C C 13 175.257 0.30 . 1 . . . . . 90 ASN C . 27744 1 880 . 1 . 1 93 93 ASN CA C 13 53.424 0.09 . 1 . . . . . 90 ASN CA . 27744 1 881 . 1 . 1 93 93 ASN CB C 13 38.807 0.30 . 1 . . . . . 90 ASN CB . 27744 1 882 . 1 . 1 93 93 ASN N N 15 118.373 0.30 . 1 . . . . . 90 ASN N . 27744 1 883 . 1 . 1 94 94 GLN H H 1 8.226 0.01 . 1 . . . . . 91 GLN H . 27744 1 884 . 1 . 1 94 94 GLN HA H 1 4.317 0.03 . 1 . . . . . 91 GLN HA . 27744 1 885 . 1 . 1 94 94 GLN HB2 H 1 2.056 0.03 . 2 . . . . . 91 GLN HB2 . 27744 1 886 . 1 . 1 94 94 GLN HB3 H 1 2.056 0.03 . 2 . . . . . 91 GLN HB3 . 27744 1 887 . 1 . 1 94 94 GLN HG2 H 1 2.272 0.03 . 2 . . . . . 91 GLN HG2 . 27744 1 888 . 1 . 1 94 94 GLN HG3 H 1 2.272 0.03 . 2 . . . . . 91 GLN HG3 . 27744 1 889 . 1 . 1 94 94 GLN C C 13 175.943 0.30 . 1 . . . . . 91 GLN C . 27744 1 890 . 1 . 1 94 94 GLN CA C 13 56.207 0.08 . 1 . . . . . 91 GLN CA . 27744 1 891 . 1 . 1 94 94 GLN CB C 13 29.385 0.10 . 1 . . . . . 91 GLN CB . 27744 1 892 . 1 . 1 94 94 GLN CG C 13 33.752 0.10 . 1 . . . . . 91 GLN CG . 27744 1 893 . 1 . 1 94 94 GLN N N 15 120.749 0.30 . 1 . . . . . 91 GLN N . 27744 1 894 . 1 . 1 95 95 LYS H H 1 8.343 0.03 . 1 . . . . . 92 LYS H . 27744 1 895 . 1 . 1 95 95 LYS HA H 1 4.303 0.05 . 1 . . . . . 92 LYS HA . 27744 1 896 . 1 . 1 95 95 LYS HB2 H 1 1.765 0.05 . 2 . . . . . 92 LYS HB2 . 27744 1 897 . 1 . 1 95 95 LYS HB3 H 1 1.765 0.05 . 2 . . . . . 92 LYS HB3 . 27744 1 898 . 1 . 1 95 95 LYS HD2 H 1 1.732 0.05 . 2 . . . . . 92 LYS HD2 . 27744 1 899 . 1 . 1 95 95 LYS HD3 H 1 1.732 0.05 . 2 . . . . . 92 LYS HD3 . 27744 1 900 . 1 . 1 95 95 LYS HE2 H 1 2.973 0.05 . 2 . . . . . 92 LYS HE2 . 27744 1 901 . 1 . 1 95 95 LYS HE3 H 1 2.973 0.05 . 2 . . . . . 92 LYS HE3 . 27744 1 902 . 1 . 1 95 95 LYS HG2 H 1 1.397 0.05 . 2 . . . . . 92 LYS HG2 . 27744 1 903 . 1 . 1 95 95 LYS HG3 H 1 1.397 0.05 . 2 . . . . . 92 LYS HG3 . 27744 1 904 . 1 . 1 95 95 LYS CA C 13 56.575 0.30 . 1 . . . . . 92 LYS CA . 27744 1 905 . 1 . 1 95 95 LYS CB C 13 32.734 0.30 . 1 . . . . . 92 LYS CB . 27744 1 906 . 1 . 1 95 95 LYS CD C 13 29.022 0.30 . 1 . . . . . 92 LYS CD . 27744 1 907 . 1 . 1 95 95 LYS CG C 13 24.566 0.30 . 1 . . . . . 92 LYS CG . 27744 1 908 . 1 . 1 95 95 LYS N N 15 122.748 0.30 . 1 . . . . . 92 LYS N . 27744 1 909 . 1 . 1 96 96 GLN HA H 1 4.359 0.03 . 1 . . . . . 93 GLN HA . 27744 1 910 . 1 . 1 96 96 GLN HB2 H 1 2.027 0.03 . 2 . . . . . 93 GLN HB2 . 27744 1 911 . 1 . 1 96 96 GLN HB3 H 1 2.034 0.03 . 2 . . . . . 93 GLN HB3 . 27744 1 912 . 1 . 1 96 96 GLN HG2 H 1 2.346 0.03 . 2 . . . . . 93 GLN HG2 . 27744 1 913 . 1 . 1 96 96 GLN HG3 H 1 2.346 0.03 . 2 . . . . . 93 GLN HG3 . 27744 1 914 . 1 . 1 96 96 GLN C C 13 175.589 0.30 . 1 . . . . . 93 GLN C . 27744 1 915 . 1 . 1 96 96 GLN CA C 13 55.504 0.30 . 1 . . . . . 93 GLN CA . 27744 1 916 . 1 . 1 96 96 GLN CB C 13 29.733 0.30 . 1 . . . . . 93 GLN CB . 27744 1 917 . 1 . 1 96 96 GLN CG C 13 33.798 0.30 . 1 . . . . . 93 GLN CG . 27744 1 918 . 1 . 1 97 97 ALA H H 1 8.409 0.03 . 1 . . . . . 94 ALA H . 27744 1 919 . 1 . 1 97 97 ALA HA H 1 4.591 0.03 . 1 . . . . . 94 ALA HA . 27744 1 920 . 1 . 1 97 97 ALA HB1 H 1 1.667 0.03 . 1 . . . . . 94 ALA HB1 . 27744 1 921 . 1 . 1 97 97 ALA HB2 H 1 1.684 0.03 . 1 . . . . . 94 ALA HB2 . 27744 1 922 . 1 . 1 97 97 ALA HB3 H 1 1.684 0.03 . 1 . . . . . 94 ALA HB3 . 27744 1 923 . 1 . 1 97 97 ALA C C 13 177.608 0.30 . 1 . . . . . 94 ALA C . 27744 1 924 . 1 . 1 97 97 ALA CA C 13 52.693 0.30 . 1 . . . . . 94 ALA CA . 27744 1 925 . 1 . 1 97 97 ALA CB C 13 19.386 0.30 . 1 . . . . . 94 ALA CB . 27744 1 926 . 1 . 1 97 97 ALA N N 15 126.310 0.30 . 1 . . . . . 94 ALA N . 27744 1 927 . 1 . 1 98 98 GLN H H 1 8.678 0.03 . 1 . . . . . 95 GLN H . 27744 1 928 . 1 . 1 98 98 GLN HA H 1 4.359 0.03 . 1 . . . . . 95 GLN HA . 27744 1 929 . 1 . 1 98 98 GLN HB2 H 1 1.825 0.03 . 2 . . . . . 95 GLN HB2 . 27744 1 930 . 1 . 1 98 98 GLN HB3 H 1 1.991 0.03 . 2 . . . . . 95 GLN HB3 . 27744 1 931 . 1 . 1 98 98 GLN HG2 H 1 2.285 0.03 . 2 . . . . . 95 GLN HG2 . 27744 1 932 . 1 . 1 98 98 GLN HG3 H 1 2.289 0.03 . 2 . . . . . 95 GLN HG3 . 27744 1 933 . 1 . 1 98 98 GLN C C 13 174.935 0.30 . 1 . . . . . 95 GLN C . 27744 1 934 . 1 . 1 98 98 GLN CA C 13 55.090 0.30 . 1 . . . . . 95 GLN CA . 27744 1 935 . 1 . 1 98 98 GLN CB C 13 30.343 0.30 . 1 . . . . . 95 GLN CB . 27744 1 936 . 1 . 1 98 98 GLN CG C 13 33.940 0.30 . 1 . . . . . 95 GLN CG . 27744 1 937 . 1 . 1 98 98 GLN N N 15 121.252 0.30 . 1 . . . . . 95 GLN N . 27744 1 938 . 1 . 1 99 99 VAL H H 1 8.211 0.03 . 1 . . . . . 96 VAL H . 27744 1 939 . 1 . 1 99 99 VAL HA H 1 4.398 0.03 . 1 . . . . . 96 VAL HA . 27744 1 940 . 1 . 1 99 99 VAL HB H 1 2.166 0.03 . 1 . . . . . 96 VAL HB . 27744 1 941 . 1 . 1 99 99 VAL HG11 H 1 0.824 0.03 . 2 . . . . . 96 VAL HG11 . 27744 1 942 . 1 . 1 99 99 VAL HG12 H 1 0.824 0.03 . 2 . . . . . 96 VAL HG12 . 27744 1 943 . 1 . 1 99 99 VAL HG13 H 1 0.824 0.03 . 2 . . . . . 96 VAL HG13 . 27744 1 944 . 1 . 1 99 99 VAL HG21 H 1 0.724 0.03 . 2 . . . . . 96 VAL HG21 . 27744 1 945 . 1 . 1 99 99 VAL HG22 H 1 0.724 0.03 . 2 . . . . . 96 VAL HG22 . 27744 1 946 . 1 . 1 99 99 VAL HG23 H 1 0.724 0.03 . 2 . . . . . 96 VAL HG23 . 27744 1 947 . 1 . 1 99 99 VAL C C 13 175.951 0.30 . 1 . . . . . 96 VAL C . 27744 1 948 . 1 . 1 99 99 VAL CA C 13 61.791 0.30 . 1 . . . . . 96 VAL CA . 27744 1 949 . 1 . 1 99 99 VAL CB C 13 32.519 0.15 . 1 . . . . . 96 VAL CB . 27744 1 950 . 1 . 1 99 99 VAL CG1 C 13 21.211 0.30 . 1 . . . . . 96 VAL CG1 . 27744 1 951 . 1 . 1 99 99 VAL CG2 C 13 21.615 0.30 . 1 . . . . . 96 VAL CG2 . 27744 1 952 . 1 . 1 99 99 VAL N N 15 121.747 0.30 . 1 . . . . . 96 VAL N . 27744 1 953 . 1 . 1 100 100 LYS H H 1 8.452 0.03 . 1 . . . . . 97 LYS H . 27744 1 954 . 1 . 1 100 100 LYS HA H 1 4.317 0.03 . 1 . . . . . 97 LYS HA . 27744 1 955 . 1 . 1 100 100 LYS HB2 H 1 1.808 0.03 . 2 . . . . . 97 LYS HB2 . 27744 1 956 . 1 . 1 100 100 LYS HB3 H 1 1.808 0.03 . 2 . . . . . 97 LYS HB3 . 27744 1 957 . 1 . 1 100 100 LYS HD2 H 1 1.768 0.03 . 2 . . . . . 97 LYS HD2 . 27744 1 958 . 1 . 1 100 100 LYS HD3 H 1 1.768 0.03 . 2 . . . . . 97 LYS HD3 . 27744 1 959 . 1 . 1 100 100 LYS HG2 H 1 1.624 0.03 . 2 . . . . . 97 LYS HG2 . 27744 1 960 . 1 . 1 100 100 LYS HG3 H 1 1.624 0.03 . 2 . . . . . 97 LYS HG3 . 27744 1 961 . 1 . 1 100 100 LYS C C 13 174.681 0.30 . 1 . . . . . 97 LYS C . 27744 1 962 . 1 . 1 100 100 LYS CA C 13 55.026 0.30 . 1 . . . . . 97 LYS CA . 27744 1 963 . 1 . 1 100 100 LYS CB C 13 33.176 0.30 . 1 . . . . . 97 LYS CB . 27744 1 964 . 1 . 1 100 100 LYS CD C 13 29.580 0.30 . 1 . . . . . 97 LYS CD . 27744 1 965 . 1 . 1 100 100 LYS CE C 13 42.281 0.30 . 1 . . . . . 97 LYS CE . 27744 1 966 . 1 . 1 100 100 LYS CG C 13 24.746 0.30 . 1 . . . . . 97 LYS CG . 27744 1 967 . 1 . 1 100 100 LYS N N 15 128.314 0.30 . 1 . . . . . 97 LYS N . 27744 1 968 . 1 . 1 101 101 GLU H H 1 8.332 0.01 . 1 . . . . . 98 GLU H . 27744 1 969 . 1 . 1 101 101 GLU HA H 1 5.532 0.03 . 1 . . . . . 98 GLU HA . 27744 1 970 . 1 . 1 101 101 GLU HB2 H 1 1.805 0.03 . 2 . . . . . 98 GLU HB2 . 27744 1 971 . 1 . 1 101 101 GLU HB3 H 1 1.894 0.03 . 2 . . . . . 98 GLU HB3 . 27744 1 972 . 1 . 1 101 101 GLU HG2 H 1 2.048 0.03 . 2 . . . . . 98 GLU HG2 . 27744 1 973 . 1 . 1 101 101 GLU HG3 H 1 2.048 0.03 . 2 . . . . . 98 GLU HG3 . 27744 1 974 . 1 . 1 101 101 GLU C C 13 175.749 0.30 . 1 . . . . . 98 GLU C . 27744 1 975 . 1 . 1 101 101 GLU CA C 13 54.822 0.30 . 1 . . . . . 98 GLU CA . 27744 1 976 . 1 . 1 101 101 GLU CB C 13 32.919 0.15 . 1 . . . . . 98 GLU CB . 27744 1 977 . 1 . 1 101 101 GLU CG C 13 36.568 0.50 . 1 . . . . . 98 GLU CG . 27744 1 978 . 1 . 1 101 101 GLU N N 15 121.876 0.30 . 1 . . . . . 98 GLU N . 27744 1 979 . 1 . 1 102 102 ILE H H 1 8.751 0.03 . 1 . . . . . 99 ILE H . 27744 1 980 . 1 . 1 102 102 ILE HA H 1 4.599 0.03 . 1 . . . . . 99 ILE HA . 27744 1 981 . 1 . 1 102 102 ILE HB H 1 2.115 0.03 . 1 . . . . . 99 ILE HB . 27744 1 982 . 1 . 1 102 102 ILE HD11 H 1 0.878 0.05 . 1 . . . . . 99 ILE HD11 . 27744 1 983 . 1 . 1 102 102 ILE HD12 H 1 0.878 0.05 . 1 . . . . . 99 ILE HD12 . 27744 1 984 . 1 . 1 102 102 ILE HD13 H 1 0.878 0.05 . 1 . . . . . 99 ILE HD13 . 27744 1 985 . 1 . 1 102 102 ILE HG12 H 1 0.936 0.05 . 2 . . . . . 99 ILE HG12 . 27744 1 986 . 1 . 1 102 102 ILE HG13 H 1 0.938 0.05 . 2 . . . . . 99 ILE HG13 . 27744 1 987 . 1 . 1 102 102 ILE HG21 H 1 0.601 0.05 . 1 . . . . . 99 ILE HG21 . 27744 1 988 . 1 . 1 102 102 ILE HG22 H 1 0.601 0.05 . 1 . . . . . 99 ILE HG22 . 27744 1 989 . 1 . 1 102 102 ILE HG23 H 1 0.601 0.05 . 1 . . . . . 99 ILE HG23 . 27744 1 990 . 1 . 1 102 102 ILE C C 13 173.427 0.30 . 1 . . . . . 99 ILE C . 27744 1 991 . 1 . 1 102 102 ILE CA C 13 59.101 0.30 . 1 . . . . . 99 ILE CA . 27744 1 992 . 1 . 1 102 102 ILE CB C 13 40.169 0.30 . 1 . . . . . 99 ILE CB . 27744 1 993 . 1 . 1 102 102 ILE CD1 C 13 11.958 0.30 . 1 . . . . . 99 ILE CD1 . 27744 1 994 . 1 . 1 102 102 ILE CG1 C 13 28.031 0.30 . 1 . . . . . 99 ILE CG1 . 27744 1 995 . 1 . 1 102 102 ILE CG2 C 13 18.190 0.30 . 1 . . . . . 99 ILE CG2 . 27744 1 996 . 1 . 1 102 102 ILE N N 15 127.019 0.30 . 1 . . . . . 99 ILE N . 27744 1 997 . 1 . 1 103 103 LYS H H 1 8.326 0.01 . 1 . . . . . 100 LYS H . 27744 1 998 . 1 . 1 103 103 LYS HA H 1 5.238 0.03 . 1 . . . . . 100 LYS HA . 27744 1 999 . 1 . 1 103 103 LYS HB2 H 1 1.656 0.03 . 2 . . . . . 100 LYS HB2 . 27744 1 1000 . 1 . 1 103 103 LYS HB3 H 1 1.656 0.03 . 2 . . . . . 100 LYS HB3 . 27744 1 1001 . 1 . 1 103 103 LYS HD2 H 1 1.684 0.03 . 2 . . . . . 100 LYS HD2 . 27744 1 1002 . 1 . 1 103 103 LYS HD3 H 1 1.684 0.03 . 2 . . . . . 100 LYS HD3 . 27744 1 1003 . 1 . 1 103 103 LYS HE2 H 1 2.824 0.03 . 2 . . . . . 100 LYS HE2 . 27744 1 1004 . 1 . 1 103 103 LYS HE3 H 1 2.824 0.03 . 2 . . . . . 100 LYS HE3 . 27744 1 1005 . 1 . 1 103 103 LYS HG2 H 1 1.275 0.03 . 2 . . . . . 100 LYS HG2 . 27744 1 1006 . 1 . 1 103 103 LYS HG3 H 1 1.275 0.03 . 2 . . . . . 100 LYS HG3 . 27744 1 1007 . 1 . 1 103 103 LYS C C 13 175.965 0.30 . 1 . . . . . 100 LYS C . 27744 1 1008 . 1 . 1 103 103 LYS CA C 13 54.931 0.30 . 1 . . . . . 100 LYS CA . 27744 1 1009 . 1 . 1 103 103 LYS CB C 13 34.444 0.30 . 1 . . . . . 100 LYS CB . 27744 1 1010 . 1 . 1 103 103 LYS CD C 13 29.544 0.30 . 1 . . . . . 100 LYS CD . 27744 1 1011 . 1 . 1 103 103 LYS CE C 13 41.879 0.30 . 1 . . . . . 100 LYS CE . 27744 1 1012 . 1 . 1 103 103 LYS CG C 13 24.874 0.30 . 1 . . . . . 100 LYS CG . 27744 1 1013 . 1 . 1 103 103 LYS N N 15 125.634 0.30 . 1 . . . . . 100 LYS N . 27744 1 1014 . 1 . 1 104 104 PHE H H 1 9.153 0.03 . 1 . . . . . 101 PHE H . 27744 1 1015 . 1 . 1 104 104 PHE HA H 1 4.552 0.03 . 1 . . . . . 101 PHE HA . 27744 1 1016 . 1 . 1 104 104 PHE HB2 H 1 2.849 0.03 . 2 . . . . . 101 PHE HB2 . 27744 1 1017 . 1 . 1 104 104 PHE HB3 H 1 2.849 0.03 . 2 . . . . . 101 PHE HB3 . 27744 1 1018 . 1 . 1 104 104 PHE HD1 H 1 7.284 0.03 . 3 . . . . . 101 PHE HD1 . 27744 1 1019 . 1 . 1 104 104 PHE HD2 H 1 7.284 0.03 . 3 . . . . . 101 PHE HD1 . 27744 1 1020 . 1 . 1 104 104 PHE HE1 H 1 7.198 0.03 . 3 . . . . . 101 PHE HE1 . 27744 1 1021 . 1 . 1 104 104 PHE HE2 H 1 7.198 0.03 . 3 . . . . . 101 PHE HE2 . 27744 1 1022 . 1 . 1 104 104 PHE C C 13 175.296 0.30 . 1 . . . . . 101 PHE C . 27744 1 1023 . 1 . 1 104 104 PHE CA C 13 57.156 0.30 . 1 . . . . . 101 PHE CA . 27744 1 1024 . 1 . 1 104 104 PHE CB C 13 44.067 0.13 . 1 . . . . . 101 PHE CB . 27744 1 1025 . 1 . 1 104 104 PHE N N 15 120.233 0.30 . 1 . . . . . 101 PHE N . 27744 1 1026 . 1 . 1 105 105 ARG H H 1 8.318 0.03 . 1 . . . . . 102 ARG H . 27744 1 1027 . 1 . 1 105 105 ARG HA H 1 4.909 0.03 . 1 . . . . . 102 ARG HA . 27744 1 1028 . 1 . 1 105 105 ARG HB2 H 1 1.650 0.05 . 2 . . . . . 102 ARG HB2 . 27744 1 1029 . 1 . 1 105 105 ARG HB3 H 1 1.959 0.05 . 2 . . . . . 102 ARG HB3 . 27744 1 1030 . 1 . 1 105 105 ARG HD2 H 1 3.226 0.05 . 2 . . . . . 102 ARG HD2 . 27744 1 1031 . 1 . 1 105 105 ARG HD3 H 1 3.226 0.05 . 2 . . . . . 102 ARG HD3 . 27744 1 1032 . 1 . 1 105 105 ARG HG2 H 1 1.668 0.05 . 2 . . . . . 102 ARG HG2 . 27744 1 1033 . 1 . 1 105 105 ARG HG3 H 1 1.668 0.05 . 2 . . . . . 102 ARG HG3 . 27744 1 1034 . 1 . 1 105 105 ARG CA C 13 53.431 0.30 . 1 . . . . . 102 ARG CA . 27744 1 1035 . 1 . 1 105 105 ARG CB C 13 30.390 0.30 . 1 . . . . . 102 ARG CB . 27744 1 1036 . 1 . 1 105 105 ARG CD C 13 42.866 0.30 . 1 . . . . . 102 ARG CD . 27744 1 1037 . 1 . 1 105 105 ARG CG C 13 27.110 0.30 . 1 . . . . . 102 ARG CG . 27744 1 1038 . 1 . 1 105 105 ARG N N 15 119.583 0.30 . 1 . . . . . 102 ARG N . 27744 1 1039 . 1 . 1 106 106 PRO HA H 1 4.226 0.05 . 1 . . . . . 103 PRO HA . 27744 1 1040 . 1 . 1 106 106 PRO HB2 H 1 2.010 0.05 . 2 . . . . . 103 PRO HB2 . 27744 1 1041 . 1 . 1 106 106 PRO HB3 H 1 2.010 0.05 . 2 . . . . . 103 PRO HB3 . 27744 1 1042 . 1 . 1 106 106 PRO HD2 H 1 3.649 0.05 . 2 . . . . . 103 PRO HD2 . 27744 1 1043 . 1 . 1 106 106 PRO HD3 H 1 3.649 0.05 . 2 . . . . . 103 PRO HD3 . 27744 1 1044 . 1 . 1 106 106 PRO C C 13 176.883 0.30 . 1 . . . . . 103 PRO C . 27744 1 1045 . 1 . 1 106 106 PRO CA C 13 64.399 0.30 . 1 . . . . . 103 PRO CA . 27744 1 1046 . 1 . 1 106 106 PRO CB C 13 31.576 0.30 . 1 . . . . . 103 PRO CB . 27744 1 1047 . 1 . 1 106 106 PRO CG C 13 28.515 0.30 . 1 . . . . . 103 PRO CG . 27744 1 1048 . 1 . 1 107 107 GLY H H 1 8.715 0.03 . 1 . . . . . 104 GLY H . 27744 1 1049 . 1 . 1 107 107 GLY HA2 H 1 4.178 0.03 . 2 . . . . . 104 GLY HA2 . 27744 1 1050 . 1 . 1 107 107 GLY HA3 H 1 4.232 0.03 . 2 . . . . . 104 GLY HA3 . 27744 1 1051 . 1 . 1 107 107 GLY C C 13 174.889 0.30 . 1 . . . . . 104 GLY C . 27744 1 1052 . 1 . 1 107 107 GLY CA C 13 45.679 0.30 . 1 . . . . . 104 GLY CA . 27744 1 1053 . 1 . 1 107 107 GLY N N 15 108.254 0.30 . 1 . . . . . 104 GLY N . 27744 1 1054 . 1 . 1 108 108 THR H H 1 7.579 0.03 . 1 . . . . . 105 THR H . 27744 1 1055 . 1 . 1 108 108 THR HA H 1 4.445 0.03 . 1 . . . . . 105 THR HA . 27744 1 1056 . 1 . 1 108 108 THR HB H 1 4.415 0.03 . 1 . . . . . 105 THR HB . 27744 1 1057 . 1 . 1 108 108 THR HG21 H 1 1.542 0.03 . 1 . . . . . 105 THR HG21 . 27744 1 1058 . 1 . 1 108 108 THR HG22 H 1 1.542 0.03 . 1 . . . . . 105 THR HG22 . 27744 1 1059 . 1 . 1 108 108 THR HG23 H 1 1.542 0.03 . 1 . . . . . 105 THR HG23 . 27744 1 1060 . 1 . 1 108 108 THR C C 13 174.260 0.30 . 1 . . . . . 105 THR C . 27744 1 1061 . 1 . 1 108 108 THR CA C 13 64.640 0.08 . 1 . . . . . 105 THR CA . 27744 1 1062 . 1 . 1 108 108 THR CB C 13 70.564 0.08 . 1 . . . . . 105 THR CB . 27744 1 1063 . 1 . 1 108 108 THR CG2 C 13 21.790 0.08 . 1 . . . . . 105 THR CG2 . 27744 1 1064 . 1 . 1 108 108 THR N N 15 116.790 0.30 . 1 . . . . . 105 THR N . 27744 1 1065 . 1 . 1 109 109 GLU H H 1 9.141 0.03 . 1 . . . . . 106 GLU H . 27744 1 1066 . 1 . 1 109 109 GLU HA H 1 4.417 0.03 . 1 . . . . . 106 GLU HA . 27744 1 1067 . 1 . 1 109 109 GLU HB2 H 1 2.369 0.03 . 2 . . . . . 106 GLU HB2 . 27744 1 1068 . 1 . 1 109 109 GLU HB3 H 1 2.105 0.03 . 2 . . . . . 106 GLU HB3 . 27744 1 1069 . 1 . 1 109 109 GLU HG2 H 1 2.512 0.03 . 2 . . . . . 106 GLU HG2 . 27744 1 1070 . 1 . 1 109 109 GLU HG3 H 1 2.665 0.03 . 2 . . . . . 106 GLU HG3 . 27744 1 1071 . 1 . 1 109 109 GLU C C 13 177.403 0.30 . 1 . . . . . 106 GLU C . 27744 1 1072 . 1 . 1 109 109 GLU CA C 13 56.619 0.30 . 1 . . . . . 106 GLU CA . 27744 1 1073 . 1 . 1 109 109 GLU CB C 13 30.721 0.30 . 1 . . . . . 106 GLU CB . 27744 1 1074 . 1 . 1 109 109 GLU CG C 13 36.706 0.30 . 1 . . . . . 106 GLU CG . 27744 1 1075 . 1 . 1 109 109 GLU N N 15 129.045 0.30 . 1 . . . . . 106 GLU N . 27744 1 1076 . 1 . 1 110 110 GLU H H 1 8.826 0.03 . 1 . . . . . 107 GLU H . 27744 1 1077 . 1 . 1 110 110 GLU HA H 1 4.257 0.03 . 1 . . . . . 107 GLU HA . 27744 1 1078 . 1 . 1 110 110 GLU HB2 H 1 1.898 0.03 . 2 . . . . . 107 GLU HB2 . 27744 1 1079 . 1 . 1 110 110 GLU HB3 H 1 2.154 0.03 . 2 . . . . . 107 GLU HB3 . 27744 1 1080 . 1 . 1 110 110 GLU HG2 H 1 2.328 0.03 . 2 . . . . . 107 GLU HG2 . 27744 1 1081 . 1 . 1 110 110 GLU HG3 H 1 2.447 0.03 . 2 . . . . . 107 GLU HG3 . 27744 1 1082 . 1 . 1 110 110 GLU C C 13 178.330 0.30 . 1 . . . . . 107 GLU C . 27744 1 1083 . 1 . 1 110 110 GLU CA C 13 59.439 0.15 . 1 . . . . . 107 GLU CA . 27744 1 1084 . 1 . 1 110 110 GLU CB C 13 29.298 0.30 . 1 . . . . . 107 GLU CB . 27744 1 1085 . 1 . 1 110 110 GLU CG C 13 34.864 0.30 . 1 . . . . . 107 GLU CG . 27744 1 1086 . 1 . 1 110 110 GLU N N 15 123.170 0.30 . 1 . . . . . 107 GLU N . 27744 1 1087 . 1 . 1 111 111 GLY H H 1 8.904 0.03 . 1 . . . . . 108 GLY H . 27744 1 1088 . 1 . 1 111 111 GLY HA2 H 1 4.143 0.03 . 2 . . . . . 108 GLY HA2 . 27744 1 1089 . 1 . 1 111 111 GLY HA3 H 1 4.143 0.03 . 2 . . . . . 108 GLY HA3 . 27744 1 1090 . 1 . 1 111 111 GLY C C 13 176.636 0.30 . 1 . . . . . 108 GLY C . 27744 1 1091 . 1 . 1 111 111 GLY CA C 13 47.344 0.30 . 1 . . . . . 108 GLY CA . 27744 1 1092 . 1 . 1 111 111 GLY N N 15 106.663 0.30 . 1 . . . . . 108 GLY N . 27744 1 1093 . 1 . 1 112 112 ASP H H 1 7.379 0.03 . 1 . . . . . 109 ASP H . 27744 1 1094 . 1 . 1 112 112 ASP HA H 1 4.825 0.03 . 1 . . . . . 109 ASP HA . 27744 1 1095 . 1 . 1 112 112 ASP HB2 H 1 3.002 0.03 . 2 . . . . . 109 ASP HB2 . 27744 1 1096 . 1 . 1 112 112 ASP HB3 H 1 3.002 0.03 . 2 . . . . . 109 ASP HB3 . 27744 1 1097 . 1 . 1 112 112 ASP CA C 13 56.650 0.30 . 1 . . . . . 109 ASP CA . 27744 1 1098 . 1 . 1 112 112 ASP CB C 13 41.559 0.30 . 1 . . . . . 109 ASP CB . 27744 1 1099 . 1 . 1 112 112 ASP N N 15 121.707 0.30 . 1 . . . . . 109 ASP N . 27744 1 1100 . 1 . 1 113 113 TYR H H 1 8.690 0.03 . 1 . . . . . 110 TYR H . 27744 1 1101 . 1 . 1 113 113 TYR HA H 1 3.923 0.05 . 1 . . . . . 110 TYR HA . 27744 1 1102 . 1 . 1 113 113 TYR HB2 H 1 2.888 0.05 . 2 . . . . . 110 TYR HB2 . 27744 1 1103 . 1 . 1 113 113 TYR HB3 H 1 3.449 0.05 . 2 . . . . . 110 TYR HB3 . 27744 1 1104 . 1 . 1 113 113 TYR HD1 H 1 6.790 0.05 . 3 . . . . . 110 TYR HD1 . 27744 1 1105 . 1 . 1 113 113 TYR HD2 H 1 7.059 0.05 . 3 . . . . . 110 TYR HD2 . 27744 1 1106 . 1 . 1 113 113 TYR HE1 H 1 7.276 0.05 . 3 . . . . . 110 TYR HE1 . 27744 1 1107 . 1 . 1 113 113 TYR HE2 H 1 7.276 0.05 . 3 . . . . . 110 TYR HE2 . 27744 1 1108 . 1 . 1 113 113 TYR C C 13 176.785 0.30 . 1 . . . . . 110 TYR C . 27744 1 1109 . 1 . 1 113 113 TYR CA C 13 63.293 0.30 . 1 . . . . . 110 TYR CA . 27744 1 1110 . 1 . 1 113 113 TYR CB C 13 38.367 0.30 . 1 . . . . . 110 TYR CB . 27744 1 1111 . 1 . 1 113 113 TYR N N 15 121.081 0.30 . 1 . . . . . 110 TYR N . 27744 1 1112 . 1 . 1 114 114 GLN H H 1 8.481 0.03 . 1 . . . . . 111 GLN H . 27744 1 1113 . 1 . 1 114 114 GLN HA H 1 3.872 0.03 . 1 . . . . . 111 GLN HA . 27744 1 1114 . 1 . 1 114 114 GLN HB2 H 1 2.226 0.03 . 2 . . . . . 111 GLN HB2 . 27744 1 1115 . 1 . 1 114 114 GLN HB3 H 1 2.226 0.03 . 2 . . . . . 111 GLN HB3 . 27744 1 1116 . 1 . 1 114 114 GLN HG2 H 1 2.743 0.03 . 2 . . . . . 111 GLN HG2 . 27744 1 1117 . 1 . 1 114 114 GLN HG3 H 1 2.818 0.03 . 2 . . . . . 111 GLN HG3 . 27744 1 1118 . 1 . 1 114 114 GLN C C 13 179.350 0.30 . 1 . . . . . 111 GLN C . 27744 1 1119 . 1 . 1 114 114 GLN CA C 13 58.741 0.30 . 1 . . . . . 111 GLN CA . 27744 1 1120 . 1 . 1 114 114 GLN CB C 13 27.631 0.30 . 1 . . . . . 111 GLN CB . 27744 1 1121 . 1 . 1 114 114 GLN CG C 13 33.460 0.30 . 1 . . . . . 111 GLN CG . 27744 1 1122 . 1 . 1 114 114 GLN N N 15 115.036 0.30 . 1 . . . . . 111 GLN N . 27744 1 1123 . 1 . 1 115 115 VAL H H 1 7.523 0.03 . 1 . . . . . 112 VAL H . 27744 1 1124 . 1 . 1 115 115 VAL HA H 1 3.801 0.03 . 1 . . . . . 112 VAL HA . 27744 1 1125 . 1 . 1 115 115 VAL HB H 1 2.429 0.03 . 1 . . . . . 112 VAL HB . 27744 1 1126 . 1 . 1 115 115 VAL HG11 H 1 0.880 0.03 . 2 . . . . . 112 VAL HG11 . 27744 1 1127 . 1 . 1 115 115 VAL HG12 H 1 0.880 0.03 . 2 . . . . . 112 VAL HG12 . 27744 1 1128 . 1 . 1 115 115 VAL HG13 H 1 0.880 0.03 . 2 . . . . . 112 VAL HG13 . 27744 1 1129 . 1 . 1 115 115 VAL HG21 H 1 1.070 0.03 . 2 . . . . . 112 VAL HG21 . 27744 1 1130 . 1 . 1 115 115 VAL HG22 H 1 1.070 0.03 . 2 . . . . . 112 VAL HG22 . 27744 1 1131 . 1 . 1 115 115 VAL HG23 H 1 1.070 0.03 . 2 . . . . . 112 VAL HG23 . 27744 1 1132 . 1 . 1 115 115 VAL C C 13 178.422 0.30 . 1 . . . . . 112 VAL C . 27744 1 1133 . 1 . 1 115 115 VAL CA C 13 66.792 0.30 . 1 . . . . . 112 VAL CA . 27744 1 1134 . 1 . 1 115 115 VAL CB C 13 31.916 0.12 . 1 . . . . . 112 VAL CB . 27744 1 1135 . 1 . 1 115 115 VAL CG1 C 13 20.935 0.12 . 1 . . . . . 112 VAL CG1 . 27744 1 1136 . 1 . 1 115 115 VAL CG2 C 13 22.709 0.12 . 1 . . . . . 112 VAL CG2 . 27744 1 1137 . 1 . 1 115 115 VAL N N 15 120.521 0.30 . 1 . . . . . 112 VAL N . 27744 1 1138 . 1 . 1 116 116 LYS H H 1 7.790 0.01 . 1 . . . . . 113 LYS H . 27744 1 1139 . 1 . 1 116 116 LYS HA H 1 3.778 0.03 . 1 . . . . . 113 LYS HA . 27744 1 1140 . 1 . 1 116 116 LYS HB2 H 1 1.220 0.03 . 2 . . . . . 113 LYS HB2 . 27744 1 1141 . 1 . 1 116 116 LYS HB3 H 1 1.647 0.03 . 2 . . . . . 113 LYS HB3 . 27744 1 1142 . 1 . 1 116 116 LYS HD2 H 1 1.668 0.03 . 2 . . . . . 113 LYS HD2 . 27744 1 1143 . 1 . 1 116 116 LYS HD3 H 1 1.668 0.03 . 2 . . . . . 113 LYS HD3 . 27744 1 1144 . 1 . 1 116 116 LYS HE2 H 1 3.141 0.03 . 2 . . . . . 113 LYS HE2 . 27744 1 1145 . 1 . 1 116 116 LYS HE3 H 1 3.141 0.03 . 2 . . . . . 113 LYS HE3 . 27744 1 1146 . 1 . 1 116 116 LYS HG2 H 1 1.134 0.03 . 2 . . . . . 113 LYS HG2 . 27744 1 1147 . 1 . 1 116 116 LYS HG3 H 1 1.134 0.03 . 2 . . . . . 113 LYS HG3 . 27744 1 1148 . 1 . 1 116 116 LYS C C 13 178.748 0.30 . 1 . . . . . 113 LYS C . 27744 1 1149 . 1 . 1 116 116 LYS CA C 13 60.351 0.30 . 1 . . . . . 113 LYS CA . 27744 1 1150 . 1 . 1 116 116 LYS CB C 13 33.218 0.30 . 1 . . . . . 113 LYS CB . 27744 1 1151 . 1 . 1 116 116 LYS CD C 13 29.295 0.30 . 1 . . . . . 113 LYS CD . 27744 1 1152 . 1 . 1 116 116 LYS CE C 13 43.168 0.30 . 1 . . . . . 113 LYS CE . 27744 1 1153 . 1 . 1 116 116 LYS CG C 13 27.204 0.30 . 1 . . . . . 113 LYS CG . 27744 1 1154 . 1 . 1 116 116 LYS N N 15 120.814 0.30 . 1 . . . . . 113 LYS N . 27744 1 1155 . 1 . 1 117 117 LEU H H 1 8.827 0.01 . 1 . . . . . 114 LEU H . 27744 1 1156 . 1 . 1 117 117 LEU HA H 1 4.120 0.03 . 1 . . . . . 114 LEU HA . 27744 1 1157 . 1 . 1 117 117 LEU HB2 H 1 1.418 0.03 . 2 . . . . . 114 LEU HB2 . 27744 1 1158 . 1 . 1 117 117 LEU HB3 H 1 1.418 0.03 . 2 . . . . . 114 LEU HB3 . 27744 1 1159 . 1 . 1 117 117 LEU HD11 H 1 0.876 0.05 . 2 . . . . . 114 LEU HD11 . 27744 1 1160 . 1 . 1 117 117 LEU HD12 H 1 0.876 0.05 . 2 . . . . . 114 LEU HD12 . 27744 1 1161 . 1 . 1 117 117 LEU HD13 H 1 0.876 0.05 . 2 . . . . . 114 LEU HD13 . 27744 1 1162 . 1 . 1 117 117 LEU HD21 H 1 0.850 0.05 . 2 . . . . . 114 LEU HD21 . 27744 1 1163 . 1 . 1 117 117 LEU HD22 H 1 0.850 0.05 . 2 . . . . . 114 LEU HD22 . 27744 1 1164 . 1 . 1 117 117 LEU HD23 H 1 0.850 0.05 . 2 . . . . . 114 LEU HD23 . 27744 1 1165 . 1 . 1 117 117 LEU HG H 1 1.551 0.05 . 1 . . . . . 114 LEU HG . 27744 1 1166 . 1 . 1 117 117 LEU C C 13 178.608 0.30 . 1 . . . . . 114 LEU C . 27744 1 1167 . 1 . 1 117 117 LEU CA C 13 57.553 0.11 . 1 . . . . . 114 LEU CA . 27744 1 1168 . 1 . 1 117 117 LEU CB C 13 40.724 0.30 . 1 . . . . . 114 LEU CB . 27744 1 1169 . 1 . 1 117 117 LEU CD1 C 13 24.798 0.50 . 1 . . . . . 114 LEU CD1 . 27744 1 1170 . 1 . 1 117 117 LEU CD2 C 13 23.947 0.50 . 1 . . . . . 114 LEU CD2 . 27744 1 1171 . 1 . 1 117 117 LEU CG C 13 27.156 0.50 . 1 . . . . . 114 LEU CG . 27744 1 1172 . 1 . 1 117 117 LEU N N 15 120.905 0.30 . 1 . . . . . 114 LEU N . 27744 1 1173 . 1 . 1 118 118 ARG H H 1 7.787 0.03 . 1 . . . . . 115 ARG H . 27744 1 1174 . 1 . 1 118 118 ARG HA H 1 3.788 0.03 . 1 . . . . . 115 ARG HA . 27744 1 1175 . 1 . 1 118 118 ARG HB2 H 1 1.886 0.03 . 2 . . . . . 115 ARG HB2 . 27744 1 1176 . 1 . 1 118 118 ARG HB3 H 1 1.886 0.03 . 2 . . . . . 115 ARG HB3 . 27744 1 1177 . 1 . 1 118 118 ARG C C 13 179.676 0.30 . 1 . . . . . 115 ARG C . 27744 1 1178 . 1 . 1 118 118 ARG CA C 13 59.477 0.18 . 1 . . . . . 115 ARG CA . 27744 1 1179 . 1 . 1 118 118 ARG CB C 13 29.409 0.30 . 1 . . . . . 115 ARG CB . 27744 1 1180 . 1 . 1 118 118 ARG CD C 13 43.487 0.30 . 1 . . . . . 115 ARG CD . 27744 1 1181 . 1 . 1 118 118 ARG CG C 13 27.473 0.30 . 1 . . . . . 115 ARG CG . 27744 1 1182 . 1 . 1 118 118 ARG N N 15 117.352 0.12 . 1 . . . . . 115 ARG N . 27744 1 1183 . 1 . 1 119 119 ASN H H 1 7.559 0.03 . 1 . . . . . 116 ASN H . 27744 1 1184 . 1 . 1 119 119 ASN HA H 1 4.320 0.03 . 1 . . . . . 116 ASN HA . 27744 1 1185 . 1 . 1 119 119 ASN HB2 H 1 2.936 0.03 . 2 . . . . . 116 ASN HB2 . 27744 1 1186 . 1 . 1 119 119 ASN HB3 H 1 2.936 0.03 . 2 . . . . . 116 ASN HB3 . 27744 1 1187 . 1 . 1 119 119 ASN C C 13 175.527 0.30 . 1 . . . . . 116 ASN C . 27744 1 1188 . 1 . 1 119 119 ASN CA C 13 55.642 0.14 . 1 . . . . . 116 ASN CA . 27744 1 1189 . 1 . 1 119 119 ASN CB C 13 37.906 0.30 . 1 . . . . . 116 ASN CB . 27744 1 1190 . 1 . 1 119 119 ASN N N 15 119.091 0.30 . 1 . . . . . 116 ASN N . 27744 1 1191 . 1 . 1 120 120 LEU H H 1 7.935 0.01 . 1 . . . . . 117 LEU H . 27744 1 1192 . 1 . 1 120 120 LEU HA H 1 3.890 0.03 . 1 . . . . . 117 LEU HA . 27744 1 1193 . 1 . 1 120 120 LEU HB2 H 1 1.307 0.05 . 2 . . . . . 117 LEU HB2 . 27744 1 1194 . 1 . 1 120 120 LEU HB3 H 1 1.307 0.05 . 2 . . . . . 117 LEU HB3 . 27744 1 1195 . 1 . 1 120 120 LEU HD11 H 1 0.784 0.05 . 2 . . . . . 117 LEU HD11 . 27744 1 1196 . 1 . 1 120 120 LEU HD12 H 1 0.784 0.05 . 2 . . . . . 117 LEU HD12 . 27744 1 1197 . 1 . 1 120 120 LEU HD13 H 1 0.784 0.05 . 2 . . . . . 117 LEU HD13 . 27744 1 1198 . 1 . 1 120 120 LEU HD21 H 1 0.874 0.05 . 2 . . . . . 117 LEU HD21 . 27744 1 1199 . 1 . 1 120 120 LEU HD22 H 1 0.874 0.05 . 2 . . . . . 117 LEU HD22 . 27744 1 1200 . 1 . 1 120 120 LEU HD23 H 1 0.874 0.05 . 2 . . . . . 117 LEU HD23 . 27744 1 1201 . 1 . 1 120 120 LEU HG H 1 1.667 0.05 . 1 . . . . . 117 LEU HG . 27744 1 1202 . 1 . 1 120 120 LEU C C 13 178.062 0.30 . 1 . . . . . 117 LEU C . 27744 1 1203 . 1 . 1 120 120 LEU CA C 13 58.673 0.12 . 1 . . . . . 117 LEU CA . 27744 1 1204 . 1 . 1 120 120 LEU CB C 13 42.408 0.30 . 1 . . . . . 117 LEU CB . 27744 1 1205 . 1 . 1 120 120 LEU CD1 C 13 25.558 0.50 . 1 . . . . . 117 LEU CD1 . 27744 1 1206 . 1 . 1 120 120 LEU CD2 C 13 25.795 0.50 . 1 . . . . . 117 LEU CD2 . 27744 1 1207 . 1 . 1 120 120 LEU CG C 13 27.301 0.50 . 1 . . . . . 117 LEU CG . 27744 1 1208 . 1 . 1 120 120 LEU N N 15 120.462 0.30 . 1 . . . . . 117 LEU N . 27744 1 1209 . 1 . 1 121 121 VAL H H 1 8.296 0.01 . 1 . . . . . 118 VAL H . 27744 1 1210 . 1 . 1 121 121 VAL HA H 1 3.140 0.03 . 1 . . . . . 118 VAL HA . 27744 1 1211 . 1 . 1 121 121 VAL HB H 1 2.025 0.03 . 1 . . . . . 118 VAL HB . 27744 1 1212 . 1 . 1 121 121 VAL HG11 H 1 0.117 0.03 . 2 . . . . . 118 VAL HG11 . 27744 1 1213 . 1 . 1 121 121 VAL HG12 H 1 0.117 0.03 . 2 . . . . . 118 VAL HG12 . 27744 1 1214 . 1 . 1 121 121 VAL HG13 H 1 0.117 0.03 . 2 . . . . . 118 VAL HG13 . 27744 1 1215 . 1 . 1 121 121 VAL HG21 H 1 0.557 0.03 . 2 . . . . . 118 VAL HG21 . 27744 1 1216 . 1 . 1 121 121 VAL HG22 H 1 0.557 0.03 . 2 . . . . . 118 VAL HG22 . 27744 1 1217 . 1 . 1 121 121 VAL HG23 H 1 0.557 0.03 . 2 . . . . . 118 VAL HG23 . 27744 1 1218 . 1 . 1 121 121 VAL C C 13 178.768 0.30 . 1 . . . . . 118 VAL C . 27744 1 1219 . 1 . 1 121 121 VAL CA C 13 67.311 0.30 . 1 . . . . . 118 VAL CA . 27744 1 1220 . 1 . 1 121 121 VAL CB C 13 31.112 0.30 . 1 . . . . . 118 VAL CB . 27744 1 1221 . 1 . 1 121 121 VAL CG1 C 13 19.912 0.30 . 1 . . . . . 118 VAL CG1 . 27744 1 1222 . 1 . 1 121 121 VAL CG2 C 13 23.096 0.30 . 1 . . . . . 118 VAL CG2 . 27744 1 1223 . 1 . 1 121 121 VAL N N 15 118.012 0.30 . 1 . . . . . 118 VAL N . 27744 1 1224 . 1 . 1 122 122 ARG H H 1 7.550 0.01 . 1 . . . . . 119 ARG H . 27744 1 1225 . 1 . 1 122 122 ARG HA H 1 3.906 0.03 . 1 . . . . . 119 ARG HA . 27744 1 1226 . 1 . 1 122 122 ARG HB2 H 1 1.926 0.03 . 2 . . . . . 119 ARG HB2 . 27744 1 1227 . 1 . 1 122 122 ARG HB3 H 1 1.926 0.03 . 2 . . . . . 119 ARG HB3 . 27744 1 1228 . 1 . 1 122 122 ARG HD2 H 1 3.139 0.03 . 2 . . . . . 119 ARG HD2 . 27744 1 1229 . 1 . 1 122 122 ARG HD3 H 1 3.139 0.03 . 2 . . . . . 119 ARG HD3 . 27744 1 1230 . 1 . 1 122 122 ARG HG2 H 1 1.552 0.03 . 2 . . . . . 119 ARG HG2 . 27744 1 1231 . 1 . 1 122 122 ARG HG3 H 1 1.552 0.03 . 2 . . . . . 119 ARG HG3 . 27744 1 1232 . 1 . 1 122 122 ARG C C 13 178.525 0.30 . 1 . . . . . 119 ARG C . 27744 1 1233 . 1 . 1 122 122 ARG CA C 13 60.108 0.30 . 1 . . . . . 119 ARG CA . 27744 1 1234 . 1 . 1 122 122 ARG CB C 13 29.128 0.30 . 1 . . . . . 119 ARG CB . 27744 1 1235 . 1 . 1 122 122 ARG CD C 13 43.477 0.30 . 1 . . . . . 119 ARG CD . 27744 1 1236 . 1 . 1 122 122 ARG CG C 13 27.234 0.30 . 1 . . . . . 119 ARG CG . 27744 1 1237 . 1 . 1 122 122 ARG N N 15 121.997 0.30 . 1 . . . . . 119 ARG N . 27744 1 1238 . 1 . 1 123 123 PHE H H 1 8.220 0.03 . 1 . . . . . 120 PHE H . 27744 1 1239 . 1 . 1 123 123 PHE HA H 1 4.152 0.03 . 1 . . . . . 120 PHE HA . 27744 1 1240 . 1 . 1 123 123 PHE HB2 H 1 3.083 0.03 . 2 . . . . . 120 PHE HB2 . 27744 1 1241 . 1 . 1 123 123 PHE HB3 H 1 3.083 0.03 . 2 . . . . . 120 PHE HB3 . 27744 1 1242 . 1 . 1 123 123 PHE HD1 H 1 7.079 0.05 . 3 . . . . . 120 PHE HD1 . 27744 1 1243 . 1 . 1 123 123 PHE HD2 H 1 7.079 0.05 . 3 . . . . . 120 PHE HD2 . 27744 1 1244 . 1 . 1 123 123 PHE HE1 H 1 7.084 0.05 . 3 . . . . . 120 PHE HE1 . 27744 1 1245 . 1 . 1 123 123 PHE HE2 H 1 7.084 0.05 . 3 . . . . . 120 PHE HE2 . 27744 1 1246 . 1 . 1 123 123 PHE C C 13 178.873 0.30 . 1 . . . . . 120 PHE C . 27744 1 1247 . 1 . 1 123 123 PHE CA C 13 57.489 0.30 . 1 . . . . . 120 PHE CA . 27744 1 1248 . 1 . 1 123 123 PHE CB C 13 37.367 0.10 . 1 . . . . . 120 PHE CB . 27744 1 1249 . 1 . 1 123 123 PHE N N 15 118.129 0.30 . 1 . . . . . 120 PHE N . 27744 1 1250 . 1 . 1 124 124 LEU H H 1 8.216 0.03 . 1 . . . . . 121 LEU H . 27744 1 1251 . 1 . 1 124 124 LEU HA H 1 4.910 0.03 . 1 . . . . . 121 LEU HA . 27744 1 1252 . 1 . 1 124 124 LEU HB2 H 1 1.536 0.05 . 2 . . . . . 121 LEU HB2 . 27744 1 1253 . 1 . 1 124 124 LEU HB3 H 1 1.801 0.05 . 2 . . . . . 121 LEU HB3 . 27744 1 1254 . 1 . 1 124 124 LEU HD11 H 1 0.731 0.05 . 2 . . . . . 121 LEU HD11 . 27744 1 1255 . 1 . 1 124 124 LEU HD12 H 1 0.731 0.05 . 2 . . . . . 121 LEU HD12 . 27744 1 1256 . 1 . 1 124 124 LEU HD13 H 1 0.731 0.05 . 2 . . . . . 121 LEU HD13 . 27744 1 1257 . 1 . 1 124 124 LEU HD21 H 1 0.884 0.05 . 2 . . . . . 121 LEU HD21 . 27744 1 1258 . 1 . 1 124 124 LEU HD22 H 1 0.884 0.05 . 2 . . . . . 121 LEU HD22 . 27744 1 1259 . 1 . 1 124 124 LEU HD23 H 1 0.884 0.05 . 2 . . . . . 121 LEU HD23 . 27744 1 1260 . 1 . 1 124 124 LEU C C 13 182.361 0.30 . 1 . . . . . 121 LEU C . 27744 1 1261 . 1 . 1 124 124 LEU CA C 13 57.739 0.30 . 1 . . . . . 121 LEU CA . 27744 1 1262 . 1 . 1 124 124 LEU CB C 13 42.299 0.30 . 1 . . . . . 121 LEU CB . 27744 1 1263 . 1 . 1 124 124 LEU CD1 C 13 28.034 0.50 . 1 . . . . . 121 LEU CD1 . 27744 1 1264 . 1 . 1 124 124 LEU CD2 C 13 22.265 0.50 . 1 . . . . . 121 LEU CD2 . 27744 1 1265 . 1 . 1 124 124 LEU CG C 13 27.881 0.50 . 1 . . . . . 121 LEU CG . 27744 1 1266 . 1 . 1 124 124 LEU N N 15 117.920 0.11 . 1 . . . . . 121 LEU N . 27744 1 1267 . 1 . 1 125 125 SER H H 1 8.755 0.03 . 1 . . . . . 122 SER H . 27744 1 1268 . 1 . 1 125 125 SER HA H 1 4.653 0.03 . 1 . . . . . 122 SER HA . 27744 1 1269 . 1 . 1 125 125 SER HB2 H 1 4.257 0.03 . 2 . . . . . 122 SER HB2 . 27744 1 1270 . 1 . 1 125 125 SER HB3 H 1 4.384 0.03 . 2 . . . . . 122 SER HB3 . 27744 1 1271 . 1 . 1 125 125 SER C C 13 175.650 0.30 . 1 . . . . . 122 SER C . 27744 1 1272 . 1 . 1 125 125 SER CA C 13 62.042 0.12 . 1 . . . . . 122 SER CA . 27744 1 1273 . 1 . 1 125 125 SER CB C 13 63.047 0.30 . 1 . . . . . 122 SER CB . 27744 1 1274 . 1 . 1 125 125 SER N N 15 117.824 0.30 . 1 . . . . . 122 SER N . 27744 1 1275 . 1 . 1 126 126 GLU H H 1 7.866 0.03 . 1 . . . . . 123 GLU H . 27744 1 1276 . 1 . 1 126 126 GLU HA H 1 4.305 0.03 . 1 . . . . . 123 GLU HA . 27744 1 1277 . 1 . 1 126 126 GLU HB2 H 1 2.257 0.03 . 2 . . . . . 123 GLU HB2 . 27744 1 1278 . 1 . 1 126 126 GLU HB3 H 1 2.275 0.03 . 2 . . . . . 123 GLU HB3 . 27744 1 1279 . 1 . 1 126 126 GLU HG2 H 1 2.664 0.03 . 2 . . . . . 123 GLU HG2 . 27744 1 1280 . 1 . 1 126 126 GLU HG3 H 1 2.664 0.03 . 2 . . . . . 123 GLU HG3 . 27744 1 1281 . 1 . 1 126 126 GLU C C 13 176.661 0.30 . 1 . . . . . 123 GLU C . 27744 1 1282 . 1 . 1 126 126 GLU CA C 13 56.695 0.30 . 1 . . . . . 123 GLU CA . 27744 1 1283 . 1 . 1 126 126 GLU CB C 13 29.444 0.30 . 1 . . . . . 123 GLU CB . 27744 1 1284 . 1 . 1 126 126 GLU CG C 13 36.916 0.30 . 1 . . . . . 123 GLU CG . 27744 1 1285 . 1 . 1 126 126 GLU N N 15 120.012 0.30 . 1 . . . . . 123 GLU N . 27744 1 1286 . 1 . 1 127 127 GLY H H 1 7.967 0.03 . 1 . . . . . 124 GLY H . 27744 1 1287 . 1 . 1 127 127 GLY HA2 H 1 4.105 0.03 . 2 . . . . . 124 GLY HA2 . 27744 1 1288 . 1 . 1 127 127 GLY HA3 H 1 4.726 0.03 . 2 . . . . . 124 GLY HA3 . 27744 1 1289 . 1 . 1 127 127 GLY C C 13 173.635 0.30 . 1 . . . . . 124 GLY C . 27744 1 1290 . 1 . 1 127 127 GLY CA C 13 45.522 0.30 . 1 . . . . . 124 GLY CA . 27744 1 1291 . 1 . 1 127 127 GLY N N 15 107.063 0.30 . 1 . . . . . 124 GLY N . 27744 1 1292 . 1 . 1 128 128 ASP H H 1 8.129 0.02 . 1 . . . . . 125 ASP H . 27744 1 1293 . 1 . 1 128 128 ASP HA H 1 5.246 0.03 . 1 . . . . . 125 ASP HA . 27744 1 1294 . 1 . 1 128 128 ASP HB2 H 1 2.597 0.03 . 2 . . . . . 125 ASP HB2 . 27744 1 1295 . 1 . 1 128 128 ASP HB3 H 1 2.863 0.03 . 2 . . . . . 125 ASP HB3 . 27744 1 1296 . 1 . 1 128 128 ASP C C 13 174.127 0.30 . 1 . . . . . 125 ASP C . 27744 1 1297 . 1 . 1 128 128 ASP CA C 13 54.175 0.30 . 1 . . . . . 125 ASP CA . 27744 1 1298 . 1 . 1 128 128 ASP CB C 13 42.466 0.11 . 1 . . . . . 125 ASP CB . 27744 1 1299 . 1 . 1 128 128 ASP N N 15 122.379 0.30 . 1 . . . . . 125 ASP N . 27744 1 1300 . 1 . 1 129 129 LYS H H 1 7.952 0.01 . 1 . . . . . 126 LYS H . 27744 1 1301 . 1 . 1 129 129 LYS HA H 1 4.600 0.03 . 1 . . . . . 126 LYS HA . 27744 1 1302 . 1 . 1 129 129 LYS HB2 H 1 1.640 0.03 . 2 . . . . . 126 LYS HB2 . 27744 1 1303 . 1 . 1 129 129 LYS HB3 H 1 1.640 0.03 . 2 . . . . . 126 LYS HB3 . 27744 1 1304 . 1 . 1 129 129 LYS HD2 H 1 1.777 0.03 . 2 . . . . . 126 LYS HD2 . 27744 1 1305 . 1 . 1 129 129 LYS HD3 H 1 1.777 0.03 . 2 . . . . . 126 LYS HD3 . 27744 1 1306 . 1 . 1 129 129 LYS HE2 H 1 3.019 0.03 . 2 . . . . . 126 LYS HE2 . 27744 1 1307 . 1 . 1 129 129 LYS HE3 H 1 3.019 0.03 . 2 . . . . . 126 LYS HE3 . 27744 1 1308 . 1 . 1 129 129 LYS HG2 H 1 1.523 0.03 . 2 . . . . . 126 LYS HG2 . 27744 1 1309 . 1 . 1 129 129 LYS HG3 H 1 1.523 0.03 . 2 . . . . . 126 LYS HG3 . 27744 1 1310 . 1 . 1 129 129 LYS C C 13 175.066 0.30 . 1 . . . . . 126 LYS C . 27744 1 1311 . 1 . 1 129 129 LYS CA C 13 56.038 0.20 . 1 . . . . . 126 LYS CA . 27744 1 1312 . 1 . 1 129 129 LYS CB C 13 34.829 0.30 . 1 . . . . . 126 LYS CB . 27744 1 1313 . 1 . 1 129 129 LYS CD C 13 30.063 0.30 . 1 . . . . . 126 LYS CD . 27744 1 1314 . 1 . 1 129 129 LYS CE C 13 42.398 0.30 . 1 . . . . . 126 LYS CE . 27744 1 1315 . 1 . 1 129 129 LYS CG C 13 26.726 0.30 . 1 . . . . . 126 LYS CG . 27744 1 1316 . 1 . 1 129 129 LYS N N 15 113.846 0.30 . 1 . . . . . 126 LYS N . 27744 1 1317 . 1 . 1 130 130 ALA H H 1 8.765 0.01 . 1 . . . . . 127 ALA H . 27744 1 1318 . 1 . 1 130 130 ALA HA H 1 5.474 0.03 . 1 . . . . . 127 ALA HA . 27744 1 1319 . 1 . 1 130 130 ALA HB1 H 1 1.439 0.03 . 1 . . . . . 127 ALA HB1 . 27744 1 1320 . 1 . 1 130 130 ALA HB2 H 1 1.443 0.03 . 1 . . . . . 127 ALA HB2 . 27744 1 1321 . 1 . 1 130 130 ALA HB3 H 1 1.456 0.03 . 1 . . . . . 127 ALA HB3 . 27744 1 1322 . 1 . 1 130 130 ALA C C 13 175.040 0.30 . 1 . . . . . 127 ALA C . 27744 1 1323 . 1 . 1 130 130 ALA CA C 13 49.985 0.15 . 1 . . . . . 127 ALA CA . 27744 1 1324 . 1 . 1 130 130 ALA CB C 13 22.285 0.30 . 1 . . . . . 127 ALA CB . 27744 1 1325 . 1 . 1 130 130 ALA N N 15 120.620 0.30 . 1 . . . . . 127 ALA N . 27744 1 1326 . 1 . 1 131 131 LYS H H 1 9.148 0.01 . 1 . . . . . 128 LYS H . 27744 1 1327 . 1 . 1 131 131 LYS HA H 1 5.055 0.03 . 1 . . . . . 128 LYS HA . 27744 1 1328 . 1 . 1 131 131 LYS HB2 H 1 1.610 0.03 . 2 . . . . . 128 LYS HB2 . 27744 1 1329 . 1 . 1 131 131 LYS HB3 H 1 1.610 0.03 . 2 . . . . . 128 LYS HB3 . 27744 1 1330 . 1 . 1 131 131 LYS HE2 H 1 2.771 0.03 . 2 . . . . . 128 LYS HE2 . 27744 1 1331 . 1 . 1 131 131 LYS HE3 H 1 2.771 0.03 . 2 . . . . . 128 LYS HE3 . 27744 1 1332 . 1 . 1 131 131 LYS HG2 H 1 1.391 0.03 . 2 . . . . . 128 LYS HG2 . 27744 1 1333 . 1 . 1 131 131 LYS HG3 H 1 1.391 0.03 . 2 . . . . . 128 LYS HG3 . 27744 1 1334 . 1 . 1 131 131 LYS C C 13 174.494 0.30 . 1 . . . . . 128 LYS C . 27744 1 1335 . 1 . 1 131 131 LYS CA C 13 54.734 0.30 . 1 . . . . . 128 LYS CA . 27744 1 1336 . 1 . 1 131 131 LYS CB C 13 34.503 0.11 . 1 . . . . . 128 LYS CB . 27744 1 1337 . 1 . 1 131 131 LYS CD C 13 29.939 0.11 . 1 . . . . . 128 LYS CD . 27744 1 1338 . 1 . 1 131 131 LYS CE C 13 41.893 0.11 . 1 . . . . . 128 LYS CE . 27744 1 1339 . 1 . 1 131 131 LYS CG C 13 25.193 0.11 . 1 . . . . . 128 LYS CG . 27744 1 1340 . 1 . 1 131 131 LYS N N 15 124.968 0.30 . 1 . . . . . 128 LYS N . 27744 1 1341 . 1 . 1 132 132 VAL H H 1 8.935 0.01 . 1 . . . . . 129 VAL H . 27744 1 1342 . 1 . 1 132 132 VAL HA H 1 5.306 0.03 . 1 . . . . . 129 VAL HA . 27744 1 1343 . 1 . 1 132 132 VAL HB H 1 2.159 0.03 . 1 . . . . . 129 VAL HB . 27744 1 1344 . 1 . 1 132 132 VAL HG11 H 1 0.870 0.03 . 2 . . . . . 129 VAL HG11 . 27744 1 1345 . 1 . 1 132 132 VAL HG12 H 1 0.870 0.03 . 2 . . . . . 129 VAL HG12 . 27744 1 1346 . 1 . 1 132 132 VAL HG13 H 1 0.870 0.03 . 2 . . . . . 129 VAL HG13 . 27744 1 1347 . 1 . 1 132 132 VAL HG21 H 1 0.925 0.03 . 2 . . . . . 129 VAL HG21 . 27744 1 1348 . 1 . 1 132 132 VAL HG22 H 1 0.925 0.03 . 2 . . . . . 129 VAL HG22 . 27744 1 1349 . 1 . 1 132 132 VAL HG23 H 1 0.925 0.03 . 2 . . . . . 129 VAL HG23 . 27744 1 1350 . 1 . 1 132 132 VAL C C 13 174.582 0.30 . 1 . . . . . 129 VAL C . 27744 1 1351 . 1 . 1 132 132 VAL CA C 13 60.752 0.30 . 1 . . . . . 129 VAL CA . 27744 1 1352 . 1 . 1 132 132 VAL CB C 13 33.377 0.23 . 1 . . . . . 129 VAL CB . 27744 1 1353 . 1 . 1 132 132 VAL CG1 C 13 21.935 0.30 . 1 . . . . . 129 VAL CG1 . 27744 1 1354 . 1 . 1 132 132 VAL CG2 C 13 22.757 0.30 . 1 . . . . . 129 VAL CG2 . 27744 1 1355 . 1 . 1 132 132 VAL N N 15 127.258 0.30 . 1 . . . . . 129 VAL N . 27744 1 1356 . 1 . 1 133 133 SER H H 1 8.776 0.01 . 1 . . . . . 130 SER H . 27744 1 1357 . 1 . 1 133 133 SER HA H 1 5.855 0.03 . 1 . . . . . 130 SER HA . 27744 1 1358 . 1 . 1 133 133 SER HB2 H 1 3.983 0.03 . 2 . . . . . 130 SER HB2 . 27744 1 1359 . 1 . 1 133 133 SER HB3 H 1 3.983 0.03 . 2 . . . . . 130 SER HB3 . 27744 1 1360 . 1 . 1 133 133 SER C C 13 172.430 0.30 . 1 . . . . . 130 SER C . 27744 1 1361 . 1 . 1 133 133 SER CA C 13 55.890 0.30 . 1 . . . . . 130 SER CA . 27744 1 1362 . 1 . 1 133 133 SER CB C 13 67.133 0.30 . 1 . . . . . 130 SER CB . 27744 1 1363 . 1 . 1 133 133 SER N N 15 120.273 0.10 . 1 . . . . . 130 SER N . 27744 1 1364 . 1 . 1 134 134 LEU H H 1 8.930 0.01 . 1 . . . . . 131 LEU H . 27744 1 1365 . 1 . 1 134 134 LEU HA H 1 4.976 0.05 . 1 . . . . . 131 LEU HA . 27744 1 1366 . 1 . 1 134 134 LEU HB2 H 1 1.438 0.05 . 2 . . . . . 131 LEU HB2 . 27744 1 1367 . 1 . 1 134 134 LEU HB3 H 1 1.438 0.05 . 2 . . . . . 131 LEU HB3 . 27744 1 1368 . 1 . 1 134 134 LEU HD11 H 1 0.365 0.05 . 2 . . . . . 131 LEU HD11 . 27744 1 1369 . 1 . 1 134 134 LEU HD12 H 1 0.365 0.05 . 2 . . . . . 131 LEU HD12 . 27744 1 1370 . 1 . 1 134 134 LEU HD13 H 1 0.365 0.05 . 2 . . . . . 131 LEU HD13 . 27744 1 1371 . 1 . 1 134 134 LEU HD21 H 1 0.589 0.05 . 2 . . . . . 131 LEU HD21 . 27744 1 1372 . 1 . 1 134 134 LEU HD22 H 1 0.589 0.05 . 2 . . . . . 131 LEU HD22 . 27744 1 1373 . 1 . 1 134 134 LEU HD23 H 1 0.589 0.05 . 2 . . . . . 131 LEU HD23 . 27744 1 1374 . 1 . 1 134 134 LEU HG H 1 0.368 0.05 . 1 . . . . . 131 LEU HG . 27744 1 1375 . 1 . 1 134 134 LEU C C 13 174.309 0.30 . 1 . . . . . 131 LEU C . 27744 1 1376 . 1 . 1 134 134 LEU CA C 13 54.161 0.30 . 1 . . . . . 131 LEU CA . 27744 1 1377 . 1 . 1 134 134 LEU CB C 13 45.292 0.30 . 1 . . . . . 131 LEU CB . 27744 1 1378 . 1 . 1 134 134 LEU CD1 C 13 25.870 0.30 . 1 . . . . . 131 LEU CD1 . 27744 1 1379 . 1 . 1 134 134 LEU CD2 C 13 26.956 0.30 . 1 . . . . . 131 LEU CD2 . 27744 1 1380 . 1 . 1 134 134 LEU CG C 13 27.355 0.30 . 1 . . . . . 131 LEU CG . 27744 1 1381 . 1 . 1 134 134 LEU N N 15 123.535 0.30 . 1 . . . . . 131 LEU N . 27744 1 1382 . 1 . 1 135 135 ARG H H 1 8.164 0.01 . 1 . . . . . 132 ARG H . 27744 1 1383 . 1 . 1 135 135 ARG HA H 1 4.877 0.03 . 1 . . . . . 132 ARG HA . 27744 1 1384 . 1 . 1 135 135 ARG HB2 H 1 1.775 0.03 . 2 . . . . . 132 ARG HB2 . 27744 1 1385 . 1 . 1 135 135 ARG HB3 H 1 1.775 0.03 . 2 . . . . . 132 ARG HB3 . 27744 1 1386 . 1 . 1 135 135 ARG HD2 H 1 3.155 0.03 . 2 . . . . . 132 ARG HD2 . 27744 1 1387 . 1 . 1 135 135 ARG HD3 H 1 3.155 0.03 . 2 . . . . . 132 ARG HD3 . 27744 1 1388 . 1 . 1 135 135 ARG HG2 H 1 1.545 0.03 . 2 . . . . . 132 ARG HG2 . 27744 1 1389 . 1 . 1 135 135 ARG HG3 H 1 1.545 0.03 . 2 . . . . . 132 ARG HG3 . 27744 1 1390 . 1 . 1 135 135 ARG C C 13 174.936 0.30 . 1 . . . . . 132 ARG C . 27744 1 1391 . 1 . 1 135 135 ARG CA C 13 54.634 0.12 . 1 . . . . . 132 ARG CA . 27744 1 1392 . 1 . 1 135 135 ARG CB C 13 32.197 0.30 . 1 . . . . . 132 ARG CB . 27744 1 1393 . 1 . 1 135 135 ARG CD C 13 43.401 0.12 . 1 . . . . . 132 ARG CD . 27744 1 1394 . 1 . 1 135 135 ARG CG C 13 27.531 0.30 . 1 . . . . . 132 ARG CG . 27744 1 1395 . 1 . 1 135 135 ARG N N 15 125.071 0.30 . 1 . . . . . 132 ARG N . 27744 1 1396 . 1 . 1 136 136 PHE H H 1 8.611 0.03 . 1 . . . . . 133 PHE H . 27744 1 1397 . 1 . 1 136 136 PHE HA H 1 5.068 0.03 . 1 . . . . . 133 PHE HA . 27744 1 1398 . 1 . 1 136 136 PHE HB2 H 1 2.960 0.03 . 2 . . . . . 133 PHE HB2 . 27744 1 1399 . 1 . 1 136 136 PHE HB3 H 1 3.120 0.03 . 2 . . . . . 133 PHE HB3 . 27744 1 1400 . 1 . 1 136 136 PHE HD1 H 1 7.195 0.03 . 3 . . . . . 133 PHE HD1 . 27744 1 1401 . 1 . 1 136 136 PHE HD2 H 1 7.195 0.03 . 3 . . . . . 133 PHE HD2 . 27744 1 1402 . 1 . 1 136 136 PHE HE1 H 1 7.202 0.03 . 3 . . . . . 133 PHE HE1 . 27744 1 1403 . 1 . 1 136 136 PHE HE2 H 1 7.202 0.03 . 3 . . . . . 133 PHE HE2 . 27744 1 1404 . 1 . 1 136 136 PHE C C 13 175.968 0.30 . 1 . . . . . 133 PHE C . 27744 1 1405 . 1 . 1 136 136 PHE CA C 13 57.311 0.14 . 1 . . . . . 133 PHE CA . 27744 1 1406 . 1 . 1 136 136 PHE CB C 13 40.882 0.23 . 1 . . . . . 133 PHE CB . 27744 1 1407 . 1 . 1 136 136 PHE N N 15 123.488 0.30 . 1 . . . . . 133 PHE N . 27744 1 1408 . 1 . 1 137 137 ARG H H 1 9.307 0.02 . 1 . . . . . 134 ARG H . 27744 1 1409 . 1 . 1 137 137 ARG HA H 1 4.537 0.02 . 1 . . . . . 134 ARG HA . 27744 1 1410 . 1 . 1 137 137 ARG HB2 H 1 1.683 0.02 . 1 . . . . . 134 ARG HB2 . 27744 1 1411 . 1 . 1 137 137 ARG HB3 H 1 1.683 0.02 . 1 . . . . . 134 ARG HB3 . 27744 1 1412 . 1 . 1 137 137 ARG C C 13 177.265 0.30 . 1 . . . . . 134 ARG C . 27744 1 1413 . 1 . 1 137 137 ARG CA C 13 55.687 0.14 . 1 . . . . . 134 ARG CA . 27744 1 1414 . 1 . 1 137 137 ARG CB C 13 31.687 0.30 . 1 . . . . . 134 ARG CB . 27744 1 1415 . 1 . 1 137 137 ARG N N 15 122.838 0.12 . 1 . . . . . 134 ARG N . 27744 1 1416 . 1 . 1 138 138 GLY H H 1 8.831 0.01 . 1 . . . . . 135 GLY H . 27744 1 1417 . 1 . 1 138 138 GLY HA2 H 1 3.622 0.03 . 2 . . . . . 135 GLY HA2 . 27744 1 1418 . 1 . 1 138 138 GLY HA3 H 1 4.507 0.03 . 2 . . . . . 135 GLY HA3 . 27744 1 1419 . 1 . 1 138 138 GLY C C 13 173.897 0.30 . 1 . . . . . 135 GLY C . 27744 1 1420 . 1 . 1 138 138 GLY CA C 13 46.968 0.07 . 1 . . . . . 135 GLY CA . 27744 1 1421 . 1 . 1 138 138 GLY N N 15 111.676 0.30 . 1 . . . . . 135 GLY N . 27744 1 1422 . 1 . 1 139 139 ARG H H 1 8.254 0.03 . 1 . . . . . 136 ARG H . 27744 1 1423 . 1 . 1 139 139 ARG HA H 1 4.341 0.03 . 1 . . . . . 136 ARG HA . 27744 1 1424 . 1 . 1 139 139 ARG HB2 H 1 1.967 0.03 . 2 . . . . . 136 ARG HB2 . 27744 1 1425 . 1 . 1 139 139 ARG HB3 H 1 1.967 0.03 . 2 . . . . . 136 ARG HB3 . 27744 1 1426 . 1 . 1 139 139 ARG HD2 H 1 3.205 0.03 . 2 . . . . . 136 ARG HD2 . 27744 1 1427 . 1 . 1 139 139 ARG HD3 H 1 3.205 0.03 . 2 . . . . . 136 ARG HD3 . 27744 1 1428 . 1 . 1 139 139 ARG HG2 H 1 1.732 0.03 . 2 . . . . . 136 ARG HG2 . 27744 1 1429 . 1 . 1 139 139 ARG HG3 H 1 1.732 0.03 . 2 . . . . . 136 ARG HG3 . 27744 1 1430 . 1 . 1 139 139 ARG C C 13 177.378 0.30 . 1 . . . . . 136 ARG C . 27744 1 1431 . 1 . 1 139 139 ARG CA C 13 57.297 0.30 . 1 . . . . . 136 ARG CA . 27744 1 1432 . 1 . 1 139 139 ARG CB C 13 29.810 0.30 . 1 . . . . . 136 ARG CB . 27744 1 1433 . 1 . 1 139 139 ARG CD C 13 43.381 0.30 . 1 . . . . . 136 ARG CD . 27744 1 1434 . 1 . 1 139 139 ARG CG C 13 27.025 0.30 . 1 . . . . . 136 ARG CG . 27744 1 1435 . 1 . 1 139 139 ARG N N 15 120.048 0.30 . 1 . . . . . 136 ARG N . 27744 1 1436 . 1 . 1 140 140 GLU H H 1 8.309 0.01 . 1 . . . . . 137 GLU H . 27744 1 1437 . 1 . 1 140 140 GLU HA H 1 4.273 0.05 . 1 . . . . . 137 GLU HA . 27744 1 1438 . 1 . 1 140 140 GLU HB2 H 1 2.281 0.05 . 1 . . . . . 137 GLU HB2 . 27744 1 1439 . 1 . 1 140 140 GLU HB3 H 1 2.281 0.05 . 1 . . . . . 137 GLU HB3 . 27744 1 1440 . 1 . 1 140 140 GLU HG2 H 1 2.421 0.05 . 1 . . . . . 137 GLU HG2 . 27744 1 1441 . 1 . 1 140 140 GLU HG3 H 1 2.421 0.05 . 1 . . . . . 137 GLU HG3 . 27744 1 1442 . 1 . 1 140 140 GLU C C 13 178.051 0.30 . 1 . . . . . 137 GLU C . 27744 1 1443 . 1 . 1 140 140 GLU CA C 13 57.443 0.20 . 1 . . . . . 137 GLU CA . 27744 1 1444 . 1 . 1 140 140 GLU CB C 13 30.294 0.30 . 1 . . . . . 137 GLU CB . 27744 1 1445 . 1 . 1 140 140 GLU CG C 13 36.579 0.30 . 1 . . . . . 137 GLU CG . 27744 1 1446 . 1 . 1 140 140 GLU N N 15 119.663 0.30 . 1 . . . . . 137 GLU N . 27744 1 1447 . 1 . 1 141 141 MET H H 1 7.892 0.03 . 1 . . . . . 138 MET H . 27744 1 1448 . 1 . 1 141 141 MET HA H 1 4.124 0.03 . 1 . . . . . 138 MET HA . 27744 1 1449 . 1 . 1 141 141 MET HB2 H 1 1.947 0.03 . 2 . . . . . 138 MET HB2 . 27744 1 1450 . 1 . 1 141 141 MET HB3 H 1 1.944 0.03 . 2 . . . . . 138 MET HB3 . 27744 1 1451 . 1 . 1 141 141 MET HE1 H 1 1.975 0.03 . 1 . . . . . 138 MET HE1 . 27744 1 1452 . 1 . 1 141 141 MET HE2 H 1 1.975 0.03 . 1 . . . . . 138 MET HE2 . 27744 1 1453 . 1 . 1 141 141 MET HE3 H 1 1.975 0.03 . 1 . . . . . 138 MET HE3 . 27744 1 1454 . 1 . 1 141 141 MET HG2 H 1 2.311 0.03 . 2 . . . . . 138 MET HG2 . 27744 1 1455 . 1 . 1 141 141 MET HG3 H 1 2.305 0.03 . 2 . . . . . 138 MET HG3 . 27744 1 1456 . 1 . 1 141 141 MET C C 13 176.588 0.30 . 1 . . . . . 138 MET C . 27744 1 1457 . 1 . 1 141 141 MET CA C 13 56.597 0.30 . 1 . . . . . 138 MET CA . 27744 1 1458 . 1 . 1 141 141 MET CB C 13 31.800 0.30 . 1 . . . . . 138 MET CB . 27744 1 1459 . 1 . 1 141 141 MET CE C 13 17.575 0.30 . 1 . . . . . 138 MET CE . 27744 1 1460 . 1 . 1 141 141 MET CG C 13 32.492 0.30 . 1 . . . . . 138 MET CG . 27744 1 1461 . 1 . 1 141 141 MET N N 15 118.562 0.30 . 1 . . . . . 138 MET N . 27744 1 1462 . 1 . 1 142 142 ALA H H 1 7.813 0.01 . 1 . . . . . 139 ALA H . 27744 1 1463 . 1 . 1 142 142 ALA HA H 1 4.391 0.03 . 1 . . . . . 139 ALA HA . 27744 1 1464 . 1 . 1 142 142 ALA HB1 H 1 1.499 0.03 . 1 . . . . . 139 ALA HB1 . 27744 1 1465 . 1 . 1 142 142 ALA HB2 H 1 1.499 0.03 . 1 . . . . . 139 ALA HB2 . 27744 1 1466 . 1 . 1 142 142 ALA HB3 H 1 1.499 0.03 . 1 . . . . . 139 ALA HB3 . 27744 1 1467 . 1 . 1 142 142 ALA C C 13 177.670 0.30 . 1 . . . . . 139 ALA C . 27744 1 1468 . 1 . 1 142 142 ALA CA C 13 53.164 0.30 . 1 . . . . . 139 ALA CA . 27744 1 1469 . 1 . 1 142 142 ALA CB C 13 18.623 0.30 . 1 . . . . . 139 ALA CB . 27744 1 1470 . 1 . 1 142 142 ALA N N 15 120.886 0.12 . 1 . . . . . 139 ALA N . 27744 1 1471 . 1 . 1 143 143 HIS H H 1 7.673 0.01 . 1 . . . . . 140 HIS H . 27744 1 1472 . 1 . 1 143 143 HIS HA H 1 5.000 0.05 . 1 . . . . . 140 HIS HA . 27744 1 1473 . 1 . 1 143 143 HIS HB2 H 1 3.024 0.05 . 2 . . . . . 140 HIS HB2 . 27744 1 1474 . 1 . 1 143 143 HIS HB3 H 1 3.316 0.05 . 2 . . . . . 140 HIS HB3 . 27744 1 1475 . 1 . 1 143 143 HIS HD2 H 1 7.134 0.05 . 1 . . . . . 140 HIS HD2 . 27744 1 1476 . 1 . 1 143 143 HIS C C 13 176.480 0.50 . 1 . . . . . 140 HIS C . 27744 1 1477 . 1 . 1 143 143 HIS CA C 13 54.912 0.30 . 1 . . . . . 140 HIS CA . 27744 1 1478 . 1 . 1 143 143 HIS CB C 13 29.152 0.30 . 1 . . . . . 140 HIS CB . 27744 1 1479 . 1 . 1 143 143 HIS N N 15 117.157 0.30 . 1 . . . . . 140 HIS N . 27744 1 1480 . 1 . 1 144 144 GLN H H 1 8.152 0.03 . 1 . . . . . 141 GLN H . 27744 1 1481 . 1 . 1 144 144 GLN HA H 1 3.850 0.03 . 1 . . . . . 141 GLN HA . 27744 1 1482 . 1 . 1 144 144 GLN HB2 H 1 2.007 0.03 . 2 . . . . . 141 GLN HB2 . 27744 1 1483 . 1 . 1 144 144 GLN HB3 H 1 2.007 0.03 . 2 . . . . . 141 GLN HB3 . 27744 1 1484 . 1 . 1 144 144 GLN HG2 H 1 2.115 0.03 . 2 . . . . . 141 GLN HG2 . 27744 1 1485 . 1 . 1 144 144 GLN HG3 H 1 2.115 0.03 . 2 . . . . . 141 GLN HG3 . 27744 1 1486 . 1 . 1 144 144 GLN C C 13 178.112 0.30 . 1 . . . . . 141 GLN C . 27744 1 1487 . 1 . 1 144 144 GLN CA C 13 58.698 0.30 . 1 . . . . . 141 GLN CA . 27744 1 1488 . 1 . 1 144 144 GLN CB C 13 28.250 0.30 . 1 . . . . . 141 GLN CB . 27744 1 1489 . 1 . 1 144 144 GLN CG C 13 33.513 0.30 . 1 . . . . . 141 GLN CG . 27744 1 1490 . 1 . 1 144 144 GLN N N 15 125.501 0.30 . 1 . . . . . 141 GLN N . 27744 1 1491 . 1 . 1 145 145 GLU H H 1 9.498 0.03 . 1 . . . . . 142 GLU H . 27744 1 1492 . 1 . 1 145 145 GLU HA H 1 4.137 0.03 . 1 . . . . . 142 GLU HA . 27744 1 1493 . 1 . 1 145 145 GLU HB2 H 1 2.111 0.03 . 2 . . . . . 142 GLU HB2 . 27744 1 1494 . 1 . 1 145 145 GLU HB3 H 1 2.111 0.03 . 2 . . . . . 142 GLU HB3 . 27744 1 1495 . 1 . 1 145 145 GLU HG2 H 1 2.407 0.03 . 2 . . . . . 142 GLU HG2 . 27744 1 1496 . 1 . 1 145 145 GLU HG3 H 1 2.328 0.03 . 2 . . . . . 142 GLU HG3 . 27744 1 1497 . 1 . 1 145 145 GLU C C 13 178.424 0.30 . 1 . . . . . 142 GLU C . 27744 1 1498 . 1 . 1 145 145 GLU CA C 13 59.735 0.14 . 1 . . . . . 142 GLU CA . 27744 1 1499 . 1 . 1 145 145 GLU CB C 13 28.053 0.30 . 1 . . . . . 142 GLU CB . 27744 1 1500 . 1 . 1 145 145 GLU CG C 13 36.019 0.30 . 1 . . . . . 142 GLU CG . 27744 1 1501 . 1 . 1 145 145 GLU N N 15 121.030 0.30 . 1 . . . . . 142 GLU N . 27744 1 1502 . 1 . 1 146 146 LEU H H 1 7.792 0.03 . 1 . . . . . 143 LEU H . 27744 1 1503 . 1 . 1 146 146 LEU HA H 1 4.473 0.03 . 1 . . . . . 143 LEU HA . 27744 1 1504 . 1 . 1 146 146 LEU HB2 H 1 1.647 0.05 . 2 . . . . . 143 LEU HB2 . 27744 1 1505 . 1 . 1 146 146 LEU HB3 H 1 1.857 0.05 . 2 . . . . . 143 LEU HB3 . 27744 1 1506 . 1 . 1 146 146 LEU HG H 1 1.763 0.05 . 1 . . . . . 143 LEU HG . 27744 1 1507 . 1 . 1 146 146 LEU HD11 H 1 0.899 0.05 . 2 . . . . . 143 LEU HD11 . 27744 1 1508 . 1 . 1 146 146 LEU HD12 H 1 0.899 0.05 . 2 . . . . . 143 LEU HD12 . 27744 1 1509 . 1 . 1 146 146 LEU HD13 H 1 0.899 0.05 . 2 . . . . . 143 LEU HD13 . 27744 1 1510 . 1 . 1 146 146 LEU HD21 H 1 0.963 0.05 . 2 . . . . . 143 LEU HD21 . 27744 1 1511 . 1 . 1 146 146 LEU HD22 H 1 0.963 0.05 . 2 . . . . . 143 LEU HD22 . 27744 1 1512 . 1 . 1 146 146 LEU HD23 H 1 0.963 0.05 . 2 . . . . . 143 LEU HD23 . 27744 1 1513 . 1 . 1 146 146 LEU C C 13 180.651 0.30 . 1 . . . . . 143 LEU C . 27744 1 1514 . 1 . 1 146 146 LEU CA C 13 57.691 0.11 . 1 . . . . . 143 LEU CA . 27744 1 1515 . 1 . 1 146 146 LEU CB C 13 42.105 0.30 . 1 . . . . . 143 LEU CB . 27744 1 1516 . 1 . 1 146 146 LEU CD1 C 13 23.289 0.30 . 1 . . . . . 143 LEU CD1 . 27744 1 1517 . 1 . 1 146 146 LEU CD2 C 13 24.834 0.30 . 1 . . . . . 143 LEU CD2 . 27744 1 1518 . 1 . 1 146 146 LEU CG C 13 27.246 0.30 . 1 . . . . . 143 LEU CG . 27744 1 1519 . 1 . 1 146 146 LEU N N 15 119.958 0.30 . 1 . . . . . 143 LEU N . 27744 1 1520 . 1 . 1 147 147 GLY H H 1 8.122 0.01 . 1 . . . . . 144 GLY H . 27744 1 1521 . 1 . 1 147 147 GLY C C 13 174.369 0.30 . 1 . . . . . 144 GLY C . 27744 1 1522 . 1 . 1 147 147 GLY CA C 13 47.414 0.30 . 1 . . . . . 144 GLY CA . 27744 1 1523 . 1 . 1 147 147 GLY N N 15 106.145 0.30 . 1 . . . . . 144 GLY N . 27744 1 1524 . 1 . 1 148 148 MET H H 1 8.080 0.03 . 1 . . . . . 145 MET H . 27744 1 1525 . 1 . 1 148 148 MET HA H 1 4.516 0.03 . 1 . . . . . 145 MET HA . 27744 1 1526 . 1 . 1 148 148 MET HB2 H 1 2.403 0.03 . 2 . . . . . 145 MET HB2 . 27744 1 1527 . 1 . 1 148 148 MET HB3 H 1 1.966 0.03 . 2 . . . . . 145 MET HB3 . 27744 1 1528 . 1 . 1 148 148 MET HE1 H 1 2.093 0.03 . 1 . . . . . 145 MET HE1 . 27744 1 1529 . 1 . 1 148 148 MET HE2 H 1 2.093 0.03 . 1 . . . . . 145 MET HE2 . 27744 1 1530 . 1 . 1 148 148 MET HE3 H 1 2.093 0.03 . 1 . . . . . 145 MET HE3 . 27744 1 1531 . 1 . 1 148 148 MET C C 13 178.640 0.30 . 1 . . . . . 145 MET C . 27744 1 1532 . 1 . 1 148 148 MET CA C 13 57.847 0.13 . 1 . . . . . 145 MET CA . 27744 1 1533 . 1 . 1 148 148 MET CB C 13 30.944 0.30 . 1 . . . . . 145 MET CB . 27744 1 1534 . 1 . 1 148 148 MET CE C 13 16.952 0.30 . 1 . . . . . 145 MET CE . 27744 1 1535 . 1 . 1 148 148 MET N N 15 120.918 0.15 . 1 . . . . . 145 MET N . 27744 1 1536 . 1 . 1 149 149 GLU H H 1 8.253 0.03 . 1 . . . . . 146 GLU H . 27744 1 1537 . 1 . 1 149 149 GLU HA H 1 3.923 0.03 . 1 . . . . . 146 GLU HA . 27744 1 1538 . 1 . 1 149 149 GLU HB2 H 1 2.039 0.03 . 2 . . . . . 146 GLU HB2 . 27744 1 1539 . 1 . 1 149 149 GLU HB3 H 1 2.047 0.03 . 2 . . . . . 146 GLU HB3 . 27744 1 1540 . 1 . 1 149 149 GLU HG2 H 1 2.383 0.03 . 2 . . . . . 146 GLU HG2 . 27744 1 1541 . 1 . 1 149 149 GLU HG3 H 1 2.284 0.03 . 2 . . . . . 146 GLU HG3 . 27744 1 1542 . 1 . 1 149 149 GLU C C 13 179.050 0.30 . 1 . . . . . 146 GLU C . 27744 1 1543 . 1 . 1 149 149 GLU CA C 13 59.388 0.15 . 1 . . . . . 146 GLU CA . 27744 1 1544 . 1 . 1 149 149 GLU CB C 13 29.244 0.30 . 1 . . . . . 146 GLU CB . 27744 1 1545 . 1 . 1 149 149 GLU CG C 13 36.234 0.30 . 1 . . . . . 146 GLU CG . 27744 1 1546 . 1 . 1 149 149 GLU N N 15 118.208 0.20 . 1 . . . . . 146 GLU N . 27744 1 1547 . 1 . 1 150 150 LEU H H 1 7.334 0.03 . 1 . . . . . 147 LEU H . 27744 1 1548 . 1 . 1 150 150 LEU HA H 1 4.435 0.03 . 1 . . . . . 147 LEU HA . 27744 1 1549 . 1 . 1 150 150 LEU HB2 H 1 1.794 0.03 . 2 . . . . . 147 LEU HB2 . 27744 1 1550 . 1 . 1 150 150 LEU HB3 H 1 1.794 0.03 . 2 . . . . . 147 LEU HB3 . 27744 1 1551 . 1 . 1 150 150 LEU HD11 H 1 0.582 0.03 . 2 . . . . . 147 LEU HD11 . 27744 1 1552 . 1 . 1 150 150 LEU HD12 H 1 0.582 0.03 . 2 . . . . . 147 LEU HD12 . 27744 1 1553 . 1 . 1 150 150 LEU HD13 H 1 0.582 0.03 . 2 . . . . . 147 LEU HD13 . 27744 1 1554 . 1 . 1 150 150 LEU HD21 H 1 0.832 0.03 . 2 . . . . . 147 LEU HD21 . 27744 1 1555 . 1 . 1 150 150 LEU HD22 H 1 0.832 0.03 . 2 . . . . . 147 LEU HD22 . 27744 1 1556 . 1 . 1 150 150 LEU HD23 H 1 0.832 0.03 . 2 . . . . . 147 LEU HD23 . 27744 1 1557 . 1 . 1 150 150 LEU HG H 1 1.363 0.03 . 1 . . . . . 147 LEU HG . 27744 1 1558 . 1 . 1 150 150 LEU C C 13 178.524 0.30 . 1 . . . . . 147 LEU C . 27744 1 1559 . 1 . 1 150 150 LEU CA C 13 58.278 0.30 . 1 . . . . . 147 LEU CA . 27744 1 1560 . 1 . 1 150 150 LEU CB C 13 41.084 0.10 . 1 . . . . . 147 LEU CB . 27744 1 1561 . 1 . 1 150 150 LEU CD1 C 13 25.365 0.30 . 1 . . . . . 147 LEU CD1 . 27744 1 1562 . 1 . 1 150 150 LEU CD2 C 13 24.480 0.30 . 1 . . . . . 147 LEU CD2 . 27744 1 1563 . 1 . 1 150 150 LEU CG C 13 27.803 0.30 . 1 . . . . . 147 LEU CG . 27744 1 1564 . 1 . 1 150 150 LEU N N 15 122.005 0.30 . 1 . . . . . 147 LEU N . 27744 1 1565 . 1 . 1 151 151 LEU H H 1 7.713 0.03 . 1 . . . . . 148 LEU H . 27744 1 1566 . 1 . 1 151 151 LEU HA H 1 4.111 0.03 . 1 . . . . . 148 LEU HA . 27744 1 1567 . 1 . 1 151 151 LEU HB2 H 1 1.767 0.05 . 2 . . . . . 148 LEU HB2 . 27744 1 1568 . 1 . 1 151 151 LEU HB3 H 1 1.735 0.05 . 2 . . . . . 148 LEU HB3 . 27744 1 1569 . 1 . 1 151 151 LEU HD11 H 1 0.605 0.05 . 2 . . . . . 148 LEU HD11 . 27744 1 1570 . 1 . 1 151 151 LEU HD12 H 1 0.605 0.05 . 2 . . . . . 148 LEU HD12 . 27744 1 1571 . 1 . 1 151 151 LEU HD13 H 1 0.605 0.05 . 2 . . . . . 148 LEU HD13 . 27744 1 1572 . 1 . 1 151 151 LEU HD21 H 1 0.747 0.05 . 2 . . . . . 148 LEU HD21 . 27744 1 1573 . 1 . 1 151 151 LEU HD22 H 1 0.747 0.05 . 2 . . . . . 148 LEU HD22 . 27744 1 1574 . 1 . 1 151 151 LEU HD23 H 1 0.747 0.05 . 2 . . . . . 148 LEU HD23 . 27744 1 1575 . 1 . 1 151 151 LEU C C 13 179.425 0.30 . 1 . . . . . 148 LEU C . 27744 1 1576 . 1 . 1 151 151 LEU CA C 13 58.506 0.30 . 1 . . . . . 148 LEU CA . 27744 1 1577 . 1 . 1 151 151 LEU CB C 13 39.605 0.30 . 1 . . . . . 148 LEU CB . 27744 1 1578 . 1 . 1 151 151 LEU CD1 C 13 22.736 0.30 . 1 . . . . . 148 LEU CD1 . 27744 1 1579 . 1 . 1 151 151 LEU CD2 C 13 26.184 0.30 . 1 . . . . . 148 LEU CD2 . 27744 1 1580 . 1 . 1 151 151 LEU N N 15 117.557 0.30 . 1 . . . . . 148 LEU N . 27744 1 1581 . 1 . 1 152 152 LYS H H 1 8.194 0.01 . 1 . . . . . 149 LYS H . 27744 1 1582 . 1 . 1 152 152 LYS HA H 1 4.153 0.03 . 1 . . . . . 149 LYS HA . 27744 1 1583 . 1 . 1 152 152 LYS HB2 H 1 1.934 0.03 . 2 . . . . . 149 LYS HB2 . 27744 1 1584 . 1 . 1 152 152 LYS HB3 H 1 1.934 0.03 . 2 . . . . . 149 LYS HB3 . 27744 1 1585 . 1 . 1 152 152 LYS HD2 H 1 1.652 0.03 . 2 . . . . . 149 LYS HD2 . 27744 1 1586 . 1 . 1 152 152 LYS HD3 H 1 1.652 0.03 . 2 . . . . . 149 LYS HD3 . 27744 1 1587 . 1 . 1 152 152 LYS HE2 H 1 2.918 0.03 . 2 . . . . . 149 LYS HE2 . 27744 1 1588 . 1 . 1 152 152 LYS HE3 H 1 2.918 0.03 . 2 . . . . . 149 LYS HE3 . 27744 1 1589 . 1 . 1 152 152 LYS HG2 H 1 1.473 0.03 . 2 . . . . . 149 LYS HG2 . 27744 1 1590 . 1 . 1 152 152 LYS HG3 H 1 1.473 0.03 . 2 . . . . . 149 LYS HG3 . 27744 1 1591 . 1 . 1 152 152 LYS C C 13 179.335 0.30 . 1 . . . . . 149 LYS C . 27744 1 1592 . 1 . 1 152 152 LYS CA C 13 59.067 0.10 . 1 . . . . . 149 LYS CA . 27744 1 1593 . 1 . 1 152 152 LYS CB C 13 31.796 0.30 . 1 . . . . . 149 LYS CB . 27744 1 1594 . 1 . 1 152 152 LYS CD C 13 28.764 0.30 . 1 . . . . . 149 LYS CD . 27744 1 1595 . 1 . 1 152 152 LYS CE C 13 41.867 0.30 . 1 . . . . . 149 LYS CE . 27744 1 1596 . 1 . 1 152 152 LYS CG C 13 25.052 0.30 . 1 . . . . . 149 LYS CG . 27744 1 1597 . 1 . 1 152 152 LYS N N 15 119.555 0.30 . 1 . . . . . 149 LYS N . 27744 1 1598 . 1 . 1 153 153 ARG H H 1 7.800 0.03 . 1 . . . . . 150 ARG H . 27744 1 1599 . 1 . 1 153 153 ARG HA H 1 3.954 0.03 . 1 . . . . . 150 ARG HA . 27744 1 1600 . 1 . 1 153 153 ARG HB2 H 1 1.875 0.03 . 2 . . . . . 150 ARG HB2 . 27744 1 1601 . 1 . 1 153 153 ARG HB3 H 1 1.875 0.03 . 2 . . . . . 150 ARG HB3 . 27744 1 1602 . 1 . 1 153 153 ARG HD2 H 1 2.817 0.03 . 2 . . . . . 150 ARG HD2 . 27744 1 1603 . 1 . 1 153 153 ARG HD3 H 1 2.817 0.03 . 2 . . . . . 150 ARG HD3 . 27744 1 1604 . 1 . 1 153 153 ARG HG2 H 1 1.705 0.05 . 2 . . . . . 150 ARG HG2 . 27744 1 1605 . 1 . 1 153 153 ARG HG3 H 1 1.745 0.05 . 2 . . . . . 150 ARG HG3 . 27744 1 1606 . 1 . 1 153 153 ARG C C 13 177.744 0.30 . 1 . . . . . 150 ARG C . 27744 1 1607 . 1 . 1 153 153 ARG CA C 13 59.759 0.11 . 1 . . . . . 150 ARG CA . 27744 1 1608 . 1 . 1 153 153 ARG CB C 13 29.800 0.25 . 1 . . . . . 150 ARG CB . 27744 1 1609 . 1 . 1 153 153 ARG CD C 13 38.305 0.31 . 1 . . . . . 150 ARG CD . 27744 1 1610 . 1 . 1 153 153 ARG CG C 13 26.333 0.25 . 1 . . . . . 150 ARG CG . 27744 1 1611 . 1 . 1 153 153 ARG N N 15 123.981 0.30 . 1 . . . . . 150 ARG N . 27744 1 1612 . 1 . 1 154 154 VAL H H 1 8.136 0.01 . 1 . . . . . 151 VAL H . 27744 1 1613 . 1 . 1 154 154 VAL HA H 1 3.917 0.03 . 1 . . . . . 151 VAL HA . 27744 1 1614 . 1 . 1 154 154 VAL HB H 1 2.314 0.03 . 1 . . . . . 151 VAL HB . 27744 1 1615 . 1 . 1 154 154 VAL HG11 H 1 0.703 0.05 . 2 . . . . . 151 VAL HG11 . 27744 1 1616 . 1 . 1 154 154 VAL HG12 H 1 0.703 0.05 . 2 . . . . . 151 VAL HG12 . 27744 1 1617 . 1 . 1 154 154 VAL HG13 H 1 0.703 0.05 . 2 . . . . . 151 VAL HG13 . 27744 1 1618 . 1 . 1 154 154 VAL HG21 H 1 0.785 0.05 . 2 . . . . . 151 VAL HG21 . 27744 1 1619 . 1 . 1 154 154 VAL HG22 H 1 0.785 0.05 . 2 . . . . . 151 VAL HG23 . 27744 1 1620 . 1 . 1 154 154 VAL HG23 H 1 0.785 0.05 . 2 . . . . . 151 VAL HG23 . 27744 1 1621 . 1 . 1 154 154 VAL C C 13 177.514 0.30 . 1 . . . . . 151 VAL C . 27744 1 1622 . 1 . 1 154 154 VAL CA C 13 66.461 0.10 . 1 . . . . . 151 VAL CA . 27744 1 1623 . 1 . 1 154 154 VAL CB C 13 31.625 0.30 . 1 . . . . . 151 VAL CB . 27744 1 1624 . 1 . 1 154 154 VAL CG1 C 13 22.799 0.30 . 1 . . . . . 151 VAL CG1 . 27744 1 1625 . 1 . 1 154 154 VAL CG2 C 13 26.372 0.30 . 1 . . . . . 151 VAL CG2 . 27744 1 1626 . 1 . 1 154 154 VAL N N 15 119.788 0.10 . 1 . . . . . 151 VAL N . 27744 1 1627 . 1 . 1 155 155 GLU H H 1 7.856 0.03 . 1 . . . . . 152 GLU H . 27744 1 1628 . 1 . 1 155 155 GLU HA H 1 3.516 0.03 . 1 . . . . . 152 GLU HA . 27744 1 1629 . 1 . 1 155 155 GLU HB2 H 1 1.853 0.03 . 1 . . . . . 152 GLU HB2 . 27744 1 1630 . 1 . 1 155 155 GLU HB3 H 1 1.853 0.03 . 1 . . . . . 152 GLU HB3 . 27744 1 1631 . 1 . 1 155 155 GLU HG2 H 1 2.162 0.03 . 1 . . . . . 152 GLU HG2 . 27744 1 1632 . 1 . 1 155 155 GLU HG3 H 1 2.222 0.03 . 1 . . . . . 152 GLU HG3 . 27744 1 1633 . 1 . 1 155 155 GLU C C 13 179.018 0.30 . 1 . . . . . 152 GLU C . 27744 1 1634 . 1 . 1 155 155 GLU CA C 13 60.181 0.30 . 1 . . . . . 152 GLU CA . 27744 1 1635 . 1 . 1 155 155 GLU CB C 13 29.570 0.12 . 1 . . . . . 152 GLU CB . 27744 1 1636 . 1 . 1 155 155 GLU CG C 13 35.594 0.12 . 1 . . . . . 152 GLU CG . 27744 1 1637 . 1 . 1 155 155 GLU N N 15 116.609 0.30 . 1 . . . . . 152 GLU N . 27744 1 1638 . 1 . 1 156 156 ALA H H 1 7.865 0.03 . 1 . . . . . 153 ALA H . 27744 1 1639 . 1 . 1 156 156 ALA HA H 1 4.445 0.03 . 1 . . . . . 153 ALA HA . 27744 1 1640 . 1 . 1 156 156 ALA HB1 H 1 1.771 0.03 . 1 . . . . . 153 ALA HB1 . 27744 1 1641 . 1 . 1 156 156 ALA HB2 H 1 1.771 0.03 . 1 . . . . . 153 ALA HB2 . 27744 1 1642 . 1 . 1 156 156 ALA HB3 H 1 1.771 0.03 . 1 . . . . . 153 ALA HB3 . 27744 1 1643 . 1 . 1 156 156 ALA C C 13 181.129 0.30 . 1 . . . . . 153 ALA C . 27744 1 1644 . 1 . 1 156 156 ALA CA C 13 55.091 0.30 . 1 . . . . . 153 ALA CA . 27744 1 1645 . 1 . 1 156 156 ALA CB C 13 18.187 0.30 . 1 . . . . . 153 ALA CB . 27744 1 1646 . 1 . 1 156 156 ALA N N 15 121.031 0.30 . 1 . . . . . 153 ALA N . 27744 1 1647 . 1 . 1 157 157 ASP H H 1 8.835 0.03 . 1 . . . . . 154 ASP H . 27744 1 1648 . 1 . 1 157 157 ASP HA H 1 4.934 0.03 . 1 . . . . . 154 ASP HA . 27744 1 1649 . 1 . 1 157 157 ASP HB2 H 1 3.119 0.03 . 2 . . . . . 154 ASP HB2 . 27744 1 1650 . 1 . 1 157 157 ASP HB3 H 1 3.119 0.03 . 2 . . . . . 154 ASP HB3 . 27744 1 1651 . 1 . 1 157 157 ASP C C 13 178.635 0.30 . 1 . . . . . 154 ASP C . 27744 1 1652 . 1 . 1 157 157 ASP CA C 13 56.439 0.30 . 1 . . . . . 154 ASP CA . 27744 1 1653 . 1 . 1 157 157 ASP CB C 13 41.187 0.30 . 1 . . . . . 154 ASP CB . 27744 1 1654 . 1 . 1 157 157 ASP N N 15 119.052 0.30 . 1 . . . . . 154 ASP N . 27744 1 1655 . 1 . 1 158 158 LEU H H 1 7.756 0.03 . 1 . . . . . 155 LEU H . 27744 1 1656 . 1 . 1 158 158 LEU HA H 1 5.083 0.03 . 1 . . . . . 155 LEU HA . 27744 1 1657 . 1 . 1 158 158 LEU HB2 H 1 1.684 0.05 . 2 . . . . . 155 LEU HB2 . 27744 1 1658 . 1 . 1 158 158 LEU HB3 H 1 1.684 0.05 . 2 . . . . . 155 LEU HB3 . 27744 1 1659 . 1 . 1 158 158 LEU HD11 H 1 0.728 0.05 . 2 . . . . . 155 LEU HD11 . 27744 1 1660 . 1 . 1 158 158 LEU HD12 H 1 0.728 0.05 . 2 . . . . . 155 LEU HD12 . 27744 1 1661 . 1 . 1 158 158 LEU HD13 H 1 0.728 0.05 . 2 . . . . . 155 LEU HD13 . 27744 1 1662 . 1 . 1 158 158 LEU HD21 H 1 0.709 0.05 . 2 . . . . . 155 LEU HD21 . 27744 1 1663 . 1 . 1 158 158 LEU HD22 H 1 0.709 0.05 . 2 . . . . . 155 LEU HD22 . 27744 1 1664 . 1 . 1 158 158 LEU HD23 H 1 0.709 0.05 . 2 . . . . . 155 LEU HD23 . 27744 1 1665 . 1 . 1 158 158 LEU C C 13 177.973 0.30 . 1 . . . . . 155 LEU C . 27744 1 1666 . 1 . 1 158 158 LEU CA C 13 53.984 0.27 . 1 . . . . . 155 LEU CA . 27744 1 1667 . 1 . 1 158 158 LEU CB C 13 42.787 0.09 . 1 . . . . . 155 LEU CB . 27744 1 1668 . 1 . 1 158 158 LEU CD1 C 13 24.028 0.30 . 1 . . . . . 155 LEU CD1 . 27744 1 1669 . 1 . 1 158 158 LEU CD2 C 13 27.908 0.30 . 1 . . . . . 155 LEU CD2 . 27744 1 1670 . 1 . 1 158 158 LEU CG C 13 25.589 0.30 . 1 . . . . . 155 LEU CG . 27744 1 1671 . 1 . 1 158 158 LEU N N 15 118.410 0.30 . 1 . . . . . 155 LEU N . 27744 1 1672 . 1 . 1 159 159 VAL H H 1 7.357 0.03 . 1 . . . . . 156 VAL H . 27744 1 1673 . 1 . 1 159 159 VAL HA H 1 4.461 0.03 . 1 . . . . . 156 VAL HA . 27744 1 1674 . 1 . 1 159 159 VAL HB H 1 2.592 0.03 . 1 . . . . . 156 VAL HB . 27744 1 1675 . 1 . 1 159 159 VAL HG11 H 1 1.141 0.05 . 2 . . . . . 156 VAL HG11 . 27744 1 1676 . 1 . 1 159 159 VAL HG12 H 1 1.141 0.05 . 2 . . . . . 156 VAL HG12 . 27744 1 1677 . 1 . 1 159 159 VAL HG13 H 1 1.141 0.05 . 2 . . . . . 156 VAL HG13 . 27744 1 1678 . 1 . 1 159 159 VAL HG21 H 1 1.166 0.05 . 2 . . . . . 156 VAL HG21 . 27744 1 1679 . 1 . 1 159 159 VAL HG22 H 1 1.166 0.05 . 2 . . . . . 156 VAL HG22 . 27744 1 1680 . 1 . 1 159 159 VAL HG23 H 1 1.166 0.05 . 2 . . . . . 156 VAL HG23 . 27744 1 1681 . 1 . 1 159 159 VAL C C 13 176.505 0.30 . 1 . . . . . 156 VAL C . 27744 1 1682 . 1 . 1 159 159 VAL CA C 13 66.064 0.30 . 1 . . . . . 156 VAL CA . 27744 1 1683 . 1 . 1 159 159 VAL CB C 13 31.981 0.30 . 1 . . . . . 156 VAL CB . 27744 1 1684 . 1 . 1 159 159 VAL CG1 C 13 20.875 0.30 . 1 . . . . . 156 VAL CG1 . 27744 1 1685 . 1 . 1 159 159 VAL CG2 C 13 21.412 0.30 . 1 . . . . . 156 VAL CG2 . 27744 1 1686 . 1 . 1 159 159 VAL N N 15 121.778 0.30 . 1 . . . . . 156 VAL N . 27744 1 1687 . 1 . 1 160 160 GLU H H 1 8.774 0.03 . 1 . . . . . 157 GLU H . 27744 1 1688 . 1 . 1 160 160 GLU HA H 1 4.045 0.03 . 1 . . . . . 157 GLU HA . 27744 1 1689 . 1 . 1 160 160 GLU HB2 H 1 1.392 0.03 . 2 . . . . . 157 GLU HB2 . 27744 1 1690 . 1 . 1 160 160 GLU HB3 H 1 1.471 0.03 . 2 . . . . . 157 GLU HB3 . 27744 1 1691 . 1 . 1 160 160 GLU HG2 H 1 1.932 0.03 . 2 . . . . . 157 GLU HG2 . 27744 1 1692 . 1 . 1 160 160 GLU HG3 H 1 2.055 0.03 . 2 . . . . . 157 GLU HG3 . 27744 1 1693 . 1 . 1 160 160 GLU C C 13 176.570 0.30 . 1 . . . . . 157 GLU C . 27744 1 1694 . 1 . 1 160 160 GLU CA C 13 57.628 0.12 . 1 . . . . . 157 GLU CA . 27744 1 1695 . 1 . 1 160 160 GLU CB C 13 29.098 0.30 . 1 . . . . . 157 GLU CB . 27744 1 1696 . 1 . 1 160 160 GLU CG C 13 36.312 0.30 . 1 . . . . . 157 GLU CG . 27744 1 1697 . 1 . 1 160 160 GLU N N 15 117.212 0.30 . 1 . . . . . 157 GLU N . 27744 1 1698 . 1 . 1 161 161 TYR H H 1 7.984 0.01 . 1 . . . . . 158 TYR H . 27744 1 1699 . 1 . 1 161 161 TYR HA H 1 4.615 0.03 . 1 . . . . . 158 TYR HA . 27744 1 1700 . 1 . 1 161 161 TYR HB2 H 1 3.276 0.03 . 2 . . . . . 158 TYR HB2 . 27744 1 1701 . 1 . 1 161 161 TYR HB3 H 1 3.504 0.03 . 2 . . . . . 158 TYR HB3 . 27744 1 1702 . 1 . 1 161 161 TYR HD1 H 1 7.028 0.05 . 3 . . . . . 158 TYR HD1 . 27744 1 1703 . 1 . 1 161 161 TYR HD2 H 1 7.028 0.05 . 3 . . . . . 158 TYR HD2 . 27744 1 1704 . 1 . 1 161 161 TYR HE1 H 1 6.844 0.05 . 3 . . . . . 158 TYR HE1 . 27744 1 1705 . 1 . 1 161 161 TYR HE2 H 1 6.844 0.05 . 3 . . . . . 158 TYR HE2 . 27744 1 1706 . 1 . 1 161 161 TYR C C 13 176.277 0.30 . 1 . . . . . 158 TYR C . 27744 1 1707 . 1 . 1 161 161 TYR CA C 13 58.720 0.30 . 1 . . . . . 158 TYR CA . 27744 1 1708 . 1 . 1 161 161 TYR CB C 13 42.659 0.30 . 1 . . . . . 158 TYR CB . 27744 1 1709 . 1 . 1 161 161 TYR N N 15 114.387 0.30 . 1 . . . . . 158 TYR N . 27744 1 1710 . 1 . 1 162 162 GLY H H 1 8.614 0.01 . 1 . . . . . 159 GLY H . 27744 1 1711 . 1 . 1 162 162 GLY HA2 H 1 5.258 0.03 . 2 . . . . . 159 GLY HA2 . 27744 1 1712 . 1 . 1 162 162 GLY HA3 H 1 3.842 0.03 . 2 . . . . . 159 GLY HA3 . 27744 1 1713 . 1 . 1 162 162 GLY C C 13 170.651 0.30 . 1 . . . . . 159 GLY C . 27744 1 1714 . 1 . 1 162 162 GLY CA C 13 46.022 0.19 . 1 . . . . . 159 GLY CA . 27744 1 1715 . 1 . 1 162 162 GLY N N 15 107.787 0.30 . 1 . . . . . 159 GLY N . 27744 1 1716 . 1 . 1 163 163 THR H H 1 9.124 0.03 . 1 . . . . . 160 THR H . 27744 1 1717 . 1 . 1 163 163 THR HA H 1 4.905 0.03 . 1 . . . . . 160 THR HA . 27744 1 1718 . 1 . 1 163 163 THR HB H 1 4.146 0.03 . 1 . . . . . 160 THR HB . 27744 1 1719 . 1 . 1 163 163 THR HG21 H 1 1.172 0.03 . 1 . . . . . 160 THR HG21 . 27744 1 1720 . 1 . 1 163 163 THR HG22 H 1 1.172 0.03 . 1 . . . . . 160 THR HG21 . 27744 1 1721 . 1 . 1 163 163 THR HG23 H 1 1.172 0.03 . 1 . . . . . 160 THR HG21 . 27744 1 1722 . 1 . 1 163 163 THR C C 13 173.631 0.30 . 1 . . . . . 160 THR C . 27744 1 1723 . 1 . 1 163 163 THR CA C 13 59.992 0.30 . 1 . . . . . 160 THR CA . 27744 1 1724 . 1 . 1 163 163 THR CB C 13 71.427 0.30 . 1 . . . . . 160 THR CB . 27744 1 1725 . 1 . 1 163 163 THR CG2 C 13 21.770 0.30 . 1 . . . . . 160 THR CG2 . 27744 1 1726 . 1 . 1 163 163 THR N N 15 114.949 0.30 . 1 . . . . . 160 THR N . 27744 1 1727 . 1 . 1 164 164 VAL H H 1 9.166 0.03 . 1 . . . . . 161 VAL H . 27744 1 1728 . 1 . 1 164 164 VAL HA H 1 4.057 0.03 . 1 . . . . . 161 VAL HA . 27744 1 1729 . 1 . 1 164 164 VAL HB H 1 2.046 0.03 . 1 . . . . . 161 VAL HB . 27744 1 1730 . 1 . 1 164 164 VAL HG11 H 1 0.363 0.05 . 2 . . . . . 161 VAL HG11 . 27744 1 1731 . 1 . 1 164 164 VAL HG12 H 1 0.363 0.05 . 2 . . . . . 161 VAL HG12 . 27744 1 1732 . 1 . 1 164 164 VAL HG13 H 1 0.363 0.05 . 2 . . . . . 161 VAL HG13 . 27744 1 1733 . 1 . 1 164 164 VAL HG21 H 1 0.845 0.05 . 2 . . . . . 161 VAL HG21 . 27744 1 1734 . 1 . 1 164 164 VAL HG22 H 1 0.845 0.05 . 2 . . . . . 161 VAL HG22 . 27744 1 1735 . 1 . 1 164 164 VAL HG23 H 1 0.845 0.05 . 2 . . . . . 161 VAL HG23 . 27744 1 1736 . 1 . 1 164 164 VAL C C 13 174.725 0.30 . 1 . . . . . 161 VAL C . 27744 1 1737 . 1 . 1 164 164 VAL CA C 13 64.738 0.30 . 1 . . . . . 161 VAL CA . 27744 1 1738 . 1 . 1 164 164 VAL CB C 13 31.243 0.30 . 1 . . . . . 161 VAL CB . 27744 1 1739 . 1 . 1 164 164 VAL CG1 C 13 20.861 0.30 . 1 . . . . . 161 VAL CG1 . 27744 1 1740 . 1 . 1 164 164 VAL CG2 C 13 22.358 0.50 . 1 . . . . . 161 VAL CG2 . 27744 1 1741 . 1 . 1 164 164 VAL N N 15 127.282 0.10 . 1 . . . . . 161 VAL N . 27744 1 1742 . 1 . 1 165 165 GLU H H 1 8.701 0.01 . 1 . . . . . 162 GLU H . 27744 1 1743 . 1 . 1 165 165 GLU HA H 1 4.344 0.03 . 1 . . . . . 162 GLU HA . 27744 1 1744 . 1 . 1 165 165 GLU HB2 H 1 1.793 0.03 . 2 . . . . . 162 GLU HB2 . 27744 1 1745 . 1 . 1 165 165 GLU HB3 H 1 1.946 0.03 . 2 . . . . . 162 GLU HB3 . 27744 1 1746 . 1 . 1 165 165 GLU HG2 H 1 2.249 0.03 . 2 . . . . . 162 GLU HG2 . 27744 1 1747 . 1 . 1 165 165 GLU HG3 H 1 2.647 0.03 . 2 . . . . . 162 GLU HG3 . 27744 1 1748 . 1 . 1 165 165 GLU C C 13 176.065 0.30 . 1 . . . . . 162 GLU C . 27744 1 1749 . 1 . 1 165 165 GLU CA C 13 57.211 0.30 . 1 . . . . . 162 GLU CA . 27744 1 1750 . 1 . 1 165 165 GLU CB C 13 32.142 0.30 . 1 . . . . . 162 GLU CB . 27744 1 1751 . 1 . 1 165 165 GLU CG C 13 37.065 0.30 . 1 . . . . . 162 GLU CG . 27744 1 1752 . 1 . 1 165 165 GLU N N 15 130.131 0.30 . 1 . . . . . 162 GLU N . 27744 1 1753 . 1 . 1 166 166 GLN H H 1 7.622 0.03 . 1 . . . . . 163 GLN H . 27744 1 1754 . 1 . 1 166 166 GLN HA H 1 4.694 0.03 . 1 . . . . . 163 GLN HA . 27744 1 1755 . 1 . 1 166 166 GLN HB2 H 1 1.932 0.03 . 2 . . . . . 163 GLN HB2 . 27744 1 1756 . 1 . 1 166 166 GLN HB3 H 1 1.953 0.03 . 2 . . . . . 163 GLN HB3 . 27744 1 1757 . 1 . 1 166 166 GLN HG2 H 1 2.293 0.03 . 2 . . . . . 163 GLN HG2 . 27744 1 1758 . 1 . 1 166 166 GLN HG3 H 1 2.295 0.03 . 2 . . . . . 163 GLN HG3 . 27744 1 1759 . 1 . 1 166 166 GLN C C 13 174.665 0.30 . 1 . . . . . 163 GLN C . 27744 1 1760 . 1 . 1 166 166 GLN CA C 13 54.739 0.30 . 1 . . . . . 163 GLN CA . 27744 1 1761 . 1 . 1 166 166 GLN CB C 13 31.295 0.30 . 1 . . . . . 163 GLN CB . 27744 1 1762 . 1 . 1 166 166 GLN CG C 13 33.424 0.30 . 1 . . . . . 163 GLN CG . 27744 1 1763 . 1 . 1 166 166 GLN N N 15 117.995 0.30 . 1 . . . . . 163 GLN N . 27744 1 1764 . 1 . 1 167 167 HIS H H 1 8.696 0.03 . 1 . . . . . 164 HIS H . 27744 1 1765 . 1 . 1 167 167 HIS HA H 1 4.236 0.05 . 1 . . . . . 164 HIS HA . 27744 1 1766 . 1 . 1 167 167 HIS HB2 H 1 3.015 0.05 . 2 . . . . . 164 HIS HB2 . 27744 1 1767 . 1 . 1 167 167 HIS HB3 H 1 3.341 0.05 . 2 . . . . . 164 HIS HB3 . 27744 1 1768 . 1 . 1 167 167 HIS HD2 H 1 7.175 0.05 . 1 . . . . . 164 HIS HD2 . 27744 1 1769 . 1 . 1 167 167 HIS CA C 13 56.647 0.30 . 1 . . . . . 164 HIS CA . 27744 1 1770 . 1 . 1 167 167 HIS CB C 13 28.378 0.30 . 1 . . . . . 164 HIS CB . 27744 1 1771 . 1 . 1 167 167 HIS N N 15 125.185 0.30 . 1 . . . . . 164 HIS N . 27744 1 1772 . 1 . 1 168 168 PRO HA H 1 4.920 0.03 . 1 . . . . . 165 PRO HA . 27744 1 1773 . 1 . 1 168 168 PRO HB2 H 1 1.945 0.03 . 2 . . . . . 165 PRO HB2 . 27744 1 1774 . 1 . 1 168 168 PRO HB3 H 1 1.945 0.03 . 2 . . . . . 165 PRO HB3 . 27744 1 1775 . 1 . 1 168 168 PRO HD2 H 1 3.865 0.03 . 2 . . . . . 165 PRO HD2 . 27744 1 1776 . 1 . 1 168 168 PRO HD3 H 1 3.865 0.03 . 2 . . . . . 165 PRO HD3 . 27744 1 1777 . 1 . 1 168 168 PRO HG2 H 1 1.914 0.03 . 2 . . . . . 165 PRO HG2 . 27744 1 1778 . 1 . 1 168 168 PRO HG3 H 1 1.914 0.03 . 2 . . . . . 165 PRO HG3 . 27744 1 1779 . 1 . 1 168 168 PRO C C 13 175.778 0.30 . 1 . . . . . 165 PRO C . 27744 1 1780 . 1 . 1 168 168 PRO CA C 13 64.018 0.30 . 1 . . . . . 165 PRO CA . 27744 1 1781 . 1 . 1 168 168 PRO CB C 13 32.154 0.30 . 1 . . . . . 165 PRO CB . 27744 1 1782 . 1 . 1 168 168 PRO CD C 13 50.258 0.30 . 1 . . . . . 165 PRO CD . 27744 1 1783 . 1 . 1 168 168 PRO CG C 13 28.076 0.30 . 1 . . . . . 165 PRO CG . 27744 1 1784 . 1 . 1 169 169 LYS H H 1 8.680 0.03 . 1 . . . . . 166 LYS H . 27744 1 1785 . 1 . 1 169 169 LYS HA H 1 4.608 0.03 . 1 . . . . . 166 LYS HA . 27744 1 1786 . 1 . 1 169 169 LYS HB2 H 1 1.858 0.03 . 2 . . . . . 166 LYS HB2 . 27744 1 1787 . 1 . 1 169 169 LYS HB3 H 1 1.858 0.03 . 2 . . . . . 166 LYS HB3 . 27744 1 1788 . 1 . 1 169 169 LYS HD2 H 1 1.667 0.03 . 2 . . . . . 166 LYS HD2 . 27744 1 1789 . 1 . 1 169 169 LYS HD3 H 1 1.667 0.03 . 2 . . . . . 166 LYS HD3 . 27744 1 1790 . 1 . 1 169 169 LYS HE2 H 1 3.125 0.03 . 2 . . . . . 166 LYS HE2 . 27744 1 1791 . 1 . 1 169 169 LYS HE3 H 1 3.125 0.03 . 2 . . . . . 166 LYS HE3 . 27744 1 1792 . 1 . 1 169 169 LYS HG2 H 1 1.406 0.03 . 2 . . . . . 166 LYS HG2 . 27744 1 1793 . 1 . 1 169 169 LYS HG3 H 1 1.406 0.03 . 2 . . . . . 166 LYS HG3 . 27744 1 1794 . 1 . 1 169 169 LYS C C 13 174.636 0.30 . 1 . . . . . 166 LYS C . 27744 1 1795 . 1 . 1 169 169 LYS CA C 13 54.925 0.30 . 1 . . . . . 166 LYS CA . 27744 1 1796 . 1 . 1 169 169 LYS CB C 13 35.595 0.30 . 1 . . . . . 166 LYS CB . 27744 1 1797 . 1 . 1 169 169 LYS CD C 13 29.339 0.30 . 1 . . . . . 166 LYS CB . 27744 1 1798 . 1 . 1 169 169 LYS CE C 13 42.119 0.30 . 1 . . . . . 166 LYS CB . 27744 1 1799 . 1 . 1 169 169 LYS CG C 13 24.262 0.30 . 1 . . . . . 166 LYS CB . 27744 1 1800 . 1 . 1 169 169 LYS N N 15 123.995 0.30 . 1 . . . . . 166 LYS N . 27744 1 1801 . 1 . 1 170 170 LEU H H 1 8.729 0.03 . 1 . . . . . 167 LEU H . 27744 1 1802 . 1 . 1 170 170 LEU HA H 1 5.143 0.03 . 1 . . . . . 167 LEU HA . 27744 1 1803 . 1 . 1 170 170 LEU HB2 H 1 1.349 0.05 . 2 . . . . . 167 LEU HB2 . 27744 1 1804 . 1 . 1 170 170 LEU HB3 H 1 1.780 0.05 . 2 . . . . . 167 LEU HB3 . 27744 1 1805 . 1 . 1 170 170 LEU HD11 H 1 0.837 0.05 . 2 . . . . . 167 LEU HD11 . 27744 1 1806 . 1 . 1 170 170 LEU HD12 H 1 0.837 0.05 . 2 . . . . . 167 LEU HD12 . 27744 1 1807 . 1 . 1 170 170 LEU HD13 H 1 0.837 0.05 . 2 . . . . . 167 LEU HD13 . 27744 1 1808 . 1 . 1 170 170 LEU HD21 H 1 0.871 0.05 . 2 . . . . . 167 LEU HD21 . 27744 1 1809 . 1 . 1 170 170 LEU HD22 H 1 0.871 0.05 . 2 . . . . . 167 LEU HD22 . 27744 1 1810 . 1 . 1 170 170 LEU HD23 H 1 0.871 0.05 . 2 . . . . . 167 LEU HD23 . 27744 1 1811 . 1 . 1 170 170 LEU HG H 1 1.494 0.05 . 1 . . . . . 167 LEU HG . 27744 1 1812 . 1 . 1 170 170 LEU C C 13 176.438 0.30 . 1 . . . . . 167 LEU C . 27744 1 1813 . 1 . 1 170 170 LEU CA C 13 54.832 0.30 . 1 . . . . . 167 LEU CA . 27744 1 1814 . 1 . 1 170 170 LEU CB C 13 43.094 0.30 . 1 . . . . . 167 LEU CB . 27744 1 1815 . 1 . 1 170 170 LEU CD1 C 13 23.667 0.30 . 1 . . . . . 167 LEU CD1 . 27744 1 1816 . 1 . 1 170 170 LEU CD2 C 13 25.515 0.30 . 1 . . . . . 167 LEU CD2 . 27744 1 1817 . 1 . 1 170 170 LEU CG C 13 27.387 0.30 . 1 . . . . . 167 LEU CG . 27744 1 1818 . 1 . 1 170 170 LEU N N 15 127.084 0.30 . 1 . . . . . 167 LEU N . 27744 1 1819 . 1 . 1 171 171 GLU H H 1 9.089 0.03 . 1 . . . . . 168 GLU H . 27744 1 1820 . 1 . 1 171 171 GLU HA H 1 4.460 0.03 . 1 . . . . . 168 GLU HA . 27744 1 1821 . 1 . 1 171 171 GLU HB2 H 1 2.011 0.03 . 2 . . . . . 168 GLU HB2 . 27744 1 1822 . 1 . 1 171 171 GLU HB3 H 1 1.958 0.03 . 2 . . . . . 168 GLU HB3 . 27744 1 1823 . 1 . 1 171 171 GLU HG2 H 1 2.154 0.03 . 2 . . . . . 168 GLU HG2 . 27744 1 1824 . 1 . 1 171 171 GLU HG3 H 1 2.365 0.03 . 2 . . . . . 168 GLU HG3 . 27744 1 1825 . 1 . 1 171 171 GLU C C 13 176.317 0.30 . 1 . . . . . 168 GLU C . 27744 1 1826 . 1 . 1 171 171 GLU CA C 13 55.622 0.30 . 1 . . . . . 168 GLU CA . 27744 1 1827 . 1 . 1 171 171 GLU CB C 13 31.256 0.30 . 1 . . . . . 168 GLU CB . 27744 1 1828 . 1 . 1 171 171 GLU CG C 13 36.327 0.30 . 1 . . . . . 168 GLU CG . 27744 1 1829 . 1 . 1 171 171 GLU N N 15 128.947 0.30 . 1 . . . . . 168 GLU N . 27744 1 1830 . 1 . 1 172 172 GLY H H 1 8.998 0.01 . 1 . . . . . 169 GLY H . 27744 1 1831 . 1 . 1 172 172 GLY HA2 H 1 3.971 0.03 . 2 . . . . . 169 GLY HA2 . 27744 1 1832 . 1 . 1 172 172 GLY HA3 H 1 5.058 0.03 . 2 . . . . . 169 GLY HA3 . 27744 1 1833 . 1 . 1 172 172 GLY C C 13 174.186 0.30 . 1 . . . . . 169 GLY C . 27744 1 1834 . 1 . 1 172 172 GLY CA C 13 47.333 0.30 . 1 . . . . . 169 GLY CA . 27744 1 1835 . 1 . 1 172 172 GLY N N 15 116.726 0.30 . 1 . . . . . 169 GLY N . 27744 1 1836 . 1 . 1 173 173 ARG H H 1 8.824 0.01 . 1 . . . . . 170 ARG H . 27744 1 1837 . 1 . 1 173 173 ARG HA H 1 4.595 0.03 . 1 . . . . . 170 ARG HA . 27744 1 1838 . 1 . 1 173 173 ARG HB2 H 1 1.776 0.03 . 2 . . . . . 170 ARG HB2 . 27744 1 1839 . 1 . 1 173 173 ARG HB3 H 1 2.485 0.03 . 2 . . . . . 170 ARG HB3 . 27744 1 1840 . 1 . 1 173 173 ARG HD2 H 1 3.229 0.03 . 2 . . . . . 170 ARG HD2 . 27744 1 1841 . 1 . 1 173 173 ARG HD3 H 1 3.229 0.03 . 2 . . . . . 170 ARG HD3 . 27744 1 1842 . 1 . 1 173 173 ARG HG2 H 1 1.682 0.03 . 2 . . . . . 170 ARG HG2 . 27744 1 1843 . 1 . 1 173 173 ARG HG3 H 1 2.682 0.03 . 2 . . . . . 170 ARG HG3 . 27744 1 1844 . 1 . 1 173 173 ARG C C 13 174.296 0.30 . 1 . . . . . 170 ARG C . 27744 1 1845 . 1 . 1 173 173 ARG CA C 13 55.656 0.30 . 1 . . . . . 170 ARG CA . 27744 1 1846 . 1 . 1 173 173 ARG CB C 13 30.215 0.30 . 1 . . . . . 170 ARG CB . 27744 1 1847 . 1 . 1 173 173 ARG CD C 13 43.643 0.30 . 1 . . . . . 170 ARG CD . 27744 1 1848 . 1 . 1 173 173 ARG CG C 13 27.446 0.30 . 1 . . . . . 170 ARG CG . 27744 1 1849 . 1 . 1 173 173 ARG N N 15 125.107 0.30 . 1 . . . . . 170 ARG N . 27744 1 1850 . 1 . 1 174 174 GLN H H 1 7.965 0.03 . 1 . . . . . 171 GLN H . 27744 1 1851 . 1 . 1 174 174 GLN HA H 1 5.315 0.03 . 1 . . . . . 171 GLN HA . 27744 1 1852 . 1 . 1 174 174 GLN HB2 H 1 2.030 0.03 . 2 . . . . . 171 GLN HB2 . 27744 1 1853 . 1 . 1 174 174 GLN HB3 H 1 2.034 0.03 . 2 . . . . . 171 GLN HB3 . 27744 1 1854 . 1 . 1 174 174 GLN HG2 H 1 2.243 0.03 . 2 . . . . . 171 GLN HG2 . 27744 1 1855 . 1 . 1 174 174 GLN HG3 H 1 2.243 0.03 . 2 . . . . . 171 GLN HG3 . 27744 1 1856 . 1 . 1 174 174 GLN C C 13 174.176 0.30 . 1 . . . . . 171 GLN C . 27744 1 1857 . 1 . 1 174 174 GLN CA C 13 54.406 0.30 . 1 . . . . . 171 GLN CA . 27744 1 1858 . 1 . 1 174 174 GLN CB C 13 32.584 0.30 . 1 . . . . . 171 GLN CB . 27744 1 1859 . 1 . 1 174 174 GLN N N 15 117.167 0.30 . 1 . . . . . 171 GLN N . 27744 1 1860 . 1 . 1 175 175 LEU H H 1 8.973 0.01 . 1 . . . . . 172 LEU H . 27744 1 1861 . 1 . 1 175 175 LEU HA H 1 5.073 0.05 . 1 . . . . . 172 LEU HA . 27744 1 1862 . 1 . 1 175 175 LEU HB2 H 1 1.577 0.05 . 2 . . . . . 172 LEU HB2 . 27744 1 1863 . 1 . 1 175 175 LEU HB3 H 1 1.577 0.05 . 2 . . . . . 172 LEU HB3 . 27744 1 1864 . 1 . 1 175 175 LEU HD11 H 1 0.886 0.05 . 2 . . . . . 172 LEU HD11 . 27744 1 1865 . 1 . 1 175 175 LEU HD12 H 1 0.886 0.05 . 2 . . . . . 172 LEU HD12 . 27744 1 1866 . 1 . 1 175 175 LEU HD13 H 1 0.886 0.05 . 2 . . . . . 172 LEU HD13 . 27744 1 1867 . 1 . 1 175 175 LEU HD21 H 1 0.903 0.05 . 2 . . . . . 172 LEU HD21 . 27744 1 1868 . 1 . 1 175 175 LEU HD22 H 1 0.903 0.05 . 2 . . . . . 172 LEU HD22 . 27744 1 1869 . 1 . 1 175 175 LEU HD23 H 1 0.903 0.05 . 2 . . . . . 172 LEU HD23 . 27744 1 1870 . 1 . 1 175 175 LEU HG H 1 1.574 0.05 . 1 . . . . . 172 LEU HG . 27744 1 1871 . 1 . 1 175 175 LEU C C 13 175.866 0.30 . 1 . . . . . 172 LEU C . 27744 1 1872 . 1 . 1 175 175 LEU CA C 13 54.088 0.17 . 1 . . . . . 172 LEU CA . 27744 1 1873 . 1 . 1 175 175 LEU CB C 13 45.817 0.30 . 1 . . . . . 172 LEU CB . 27744 1 1874 . 1 . 1 175 175 LEU CD1 C 13 24.699 0.30 . 1 . . . . . 172 LEU CD1 . 27744 1 1875 . 1 . 1 175 175 LEU CD2 C 13 24.787 0.30 . 1 . . . . . 172 LEU CD2 . 27744 1 1876 . 1 . 1 175 175 LEU CG C 13 27.051 0.30 . 1 . . . . . 172 LEU CG . 27744 1 1877 . 1 . 1 175 175 LEU N N 15 125.640 0.30 . 1 . . . . . 172 LEU N . 27744 1 1878 . 1 . 1 176 176 MET H H 1 8.618 0.01 . 1 . . . . . 173 MET H . 27744 1 1879 . 1 . 1 176 176 MET HA H 1 5.874 0.03 . 1 . . . . . 173 MET HA . 27744 1 1880 . 1 . 1 176 176 MET HB2 H 1 2.204 0.03 . 2 . . . . . 173 MET HB2 . 27744 1 1881 . 1 . 1 176 176 MET HB3 H 1 2.128 0.03 . 2 . . . . . 173 MET HB3 . 27744 1 1882 . 1 . 1 176 176 MET HE1 H 1 2.010 0.03 . 1 . . . . . 173 MET HE1 . 27744 1 1883 . 1 . 1 176 176 MET HE2 H 1 2.010 0.03 . 1 . . . . . 173 MET HE2 . 27744 1 1884 . 1 . 1 176 176 MET HE3 H 1 2.010 0.03 . 1 . . . . . 173 MET HE3 . 27744 1 1885 . 1 . 1 176 176 MET HG2 H 1 2.451 0.03 . 2 . . . . . 173 MET HG2 . 27744 1 1886 . 1 . 1 176 176 MET HG3 H 1 2.524 0.03 . 2 . . . . . 173 MET HG3 . 27744 1 1887 . 1 . 1 176 176 MET C C 13 174.009 0.30 . 1 . . . . . 173 MET C . 27744 1 1888 . 1 . 1 176 176 MET CA C 13 54.166 0.12 . 1 . . . . . 173 MET CA . 27744 1 1889 . 1 . 1 176 176 MET CB C 13 36.047 0.30 . 1 . . . . . 173 MET CB . 27744 1 1890 . 1 . 1 176 176 MET CE C 13 17.826 0.30 . 1 . . . . . 173 MET CE . 27744 1 1891 . 1 . 1 176 176 MET CG C 13 31.185 0.30 . 1 . . . . . 173 MET CG . 27744 1 1892 . 1 . 1 176 176 MET N N 15 120.747 0.30 . 1 . . . . . 173 MET N . 27744 1 1893 . 1 . 1 177 177 MET H H 1 8.963 0.01 . 1 . . . . . 174 MET H . 27744 1 1894 . 1 . 1 177 177 MET HA H 1 4.998 0.03 . 1 . . . . . 174 MET HA . 27744 1 1895 . 1 . 1 177 177 MET HB2 H 1 1.664 0.03 . 2 . . . . . 174 MET HB2 . 27744 1 1896 . 1 . 1 177 177 MET HB3 H 1 2.313 0.03 . 2 . . . . . 174 MET HB3 . 27744 1 1897 . 1 . 1 177 177 MET HE1 H 1 2.003 0.03 . 1 . . . . . 174 MET HE1 . 27744 1 1898 . 1 . 1 177 177 MET HE2 H 1 2.003 0.03 . 1 . . . . . 174 MET HE2 . 27744 1 1899 . 1 . 1 177 177 MET HE3 H 1 2.003 0.03 . 1 . . . . . 174 MET HE3 . 27744 1 1900 . 1 . 1 177 177 MET HG2 H 1 2.371 0.03 . 2 . . . . . 174 MET HG2 . 27744 1 1901 . 1 . 1 177 177 MET HG3 H 1 2.371 0.03 . 2 . . . . . 174 MET HG3 . 27744 1 1902 . 1 . 1 177 177 MET C C 13 173.032 0.30 . 1 . . . . . 174 MET C . 27744 1 1903 . 1 . 1 177 177 MET CA C 13 54.534 0.11 . 1 . . . . . 174 MET CA . 27744 1 1904 . 1 . 1 177 177 MET CB C 13 37.154 0.30 . 1 . . . . . 174 MET CB . 27744 1 1905 . 1 . 1 177 177 MET CE C 13 16.896 0.30 . 1 . . . . . 174 MET CE . 27744 1 1906 . 1 . 1 177 177 MET CG C 13 31.260 0.30 . 1 . . . . . 174 MET CG . 27744 1 1907 . 1 . 1 177 177 MET N N 15 120.611 0.30 . 1 . . . . . 174 MET N . 27744 1 1908 . 1 . 1 178 178 VAL H H 1 8.526 0.01 . 1 . . . . . 175 VAL H . 27744 1 1909 . 1 . 1 178 178 VAL HA H 1 5.312 0.03 . 1 . . . . . 175 VAL HA . 27744 1 1910 . 1 . 1 178 178 VAL HB H 1 1.780 0.03 . 1 . . . . . 175 VAL HB . 27744 1 1911 . 1 . 1 178 178 VAL HG11 H 1 0.796 0.05 . 2 . . . . . 175 VAL HG11 . 27744 1 1912 . 1 . 1 178 178 VAL HG12 H 1 0.796 0.05 . 2 . . . . . 175 VAL HG12 . 27744 1 1913 . 1 . 1 178 178 VAL HG13 H 1 0.796 0.05 . 2 . . . . . 175 VAL HG13 . 27744 1 1914 . 1 . 1 178 178 VAL HG21 H 1 0.837 0.05 . 2 . . . . . 175 VAL HG21 . 27744 1 1915 . 1 . 1 178 178 VAL HG22 H 1 0.837 0.05 . 2 . . . . . 175 VAL HG22 . 27744 1 1916 . 1 . 1 178 178 VAL HG23 H 1 0.837 0.05 . 2 . . . . . 175 VAL HG23 . 27744 1 1917 . 1 . 1 178 178 VAL C C 13 174.830 0.30 . 1 . . . . . 175 VAL C . 27744 1 1918 . 1 . 1 178 178 VAL CA C 13 61.857 0.30 . 1 . . . . . 175 VAL CA . 27744 1 1919 . 1 . 1 178 178 VAL CB C 13 34.751 0.30 . 1 . . . . . 175 VAL CB . 27744 1 1920 . 1 . 1 178 178 VAL CG1 C 13 21.023 0.30 . 1 . . . . . 175 VAL CG1 . 27744 1 1921 . 1 . 1 178 178 VAL CG2 C 13 21.007 0.30 . 1 . . . . . 175 VAL CG2 . 27744 1 1922 . 1 . 1 178 178 VAL N N 15 120.676 0.30 . 1 . . . . . 175 VAL N . 27744 1 1923 . 1 . 1 179 179 ILE H H 1 9.553 0.01 . 1 . . . . . 176 ILE H . 27744 1 1924 . 1 . 1 179 179 ILE HA H 1 4.909 0.03 . 1 . . . . . 176 ILE HA . 27744 1 1925 . 1 . 1 179 179 ILE HB H 1 1.756 0.05 . 1 . . . . . 176 ILE HB . 27744 1 1926 . 1 . 1 179 179 ILE HD11 H 1 0.756 0.05 . 1 . . . . . 176 ILE HD11 . 27744 1 1927 . 1 . 1 179 179 ILE HD12 H 1 0.756 0.05 . 1 . . . . . 176 ILE HD12 . 27744 1 1928 . 1 . 1 179 179 ILE HD13 H 1 0.756 0.05 . 1 . . . . . 176 ILE HD13 . 27744 1 1929 . 1 . 1 179 179 ILE HG12 H 1 1.018 0.05 . 2 . . . . . 176 ILE HG12 . 27744 1 1930 . 1 . 1 179 179 ILE HG13 H 1 1.430 0.05 . 2 . . . . . 176 ILE HG13 . 27744 1 1931 . 1 . 1 179 179 ILE HG21 H 1 0.827 0.05 . 1 . . . . . 176 ILE HG21 . 27744 1 1932 . 1 . 1 179 179 ILE HG22 H 1 0.827 0.05 . 1 . . . . . 176 ILE HG22 . 27744 1 1933 . 1 . 1 179 179 ILE HG23 H 1 0.827 0.05 . 1 . . . . . 176 ILE HG23 . 27744 1 1934 . 1 . 1 179 179 ILE C C 13 172.694 0.30 . 1 . . . . . 176 ILE C . 27744 1 1935 . 1 . 1 179 179 ILE CA C 13 59.678 0.11 . 1 . . . . . 176 ILE CA . 27744 1 1936 . 1 . 1 179 179 ILE CB C 13 40.550 0.30 . 1 . . . . . 176 ILE CB . 27744 1 1937 . 1 . 1 179 179 ILE CD1 C 13 14.027 0.30 . 1 . . . . . 176 ILE CD1 . 27744 1 1938 . 1 . 1 179 179 ILE CG1 C 13 28.215 0.30 . 1 . . . . . 176 ILE CG1 . 27744 1 1939 . 1 . 1 179 179 ILE CG2 C 13 18.367 0.30 . 1 . . . . . 176 ILE CG2 . 27744 1 1940 . 1 . 1 179 179 ILE N N 15 129.107 0.30 . 1 . . . . . 176 ILE N . 27744 1 1941 . 1 . 1 180 180 ALA H H 1 9.063 0.01 . 1 . . . . . 177 ALA H . 27744 1 1942 . 1 . 1 180 180 ALA CA C 13 48.535 0.30 . 1 . . . . . 177 ALA CA . 27744 1 1943 . 1 . 1 180 180 ALA CB C 13 20.078 0.30 . 1 . . . . . 177 ALA CB . 27744 1 1944 . 1 . 1 180 180 ALA N N 15 129.080 0.30 . 1 . . . . . 177 ALA N . 27744 1 1945 . 1 . 1 181 181 PRO HA H 1 4.923 0.03 . 1 . . . . . 178 PRO HA . 27744 1 1946 . 1 . 1 181 181 PRO HB2 H 1 2.100 0.03 . 2 . . . . . 178 PRO HB2 . 27744 1 1947 . 1 . 1 181 181 PRO HB3 H 1 2.584 0.03 . 2 . . . . . 178 PRO HB3 . 27744 1 1948 . 1 . 1 181 181 PRO HB2 H 1 2.100 0.03 . 2 . . . . . 178 PRO HB2 . 27744 1 1949 . 1 . 1 181 181 PRO HD2 H 1 3.821 0.03 . 2 . . . . . 178 PRO HD2 . 27744 1 1950 . 1 . 1 181 181 PRO HD3 H 1 3.821 0.03 . 2 . . . . . 178 PRO HD3 . 27744 1 1951 . 1 . 1 181 181 PRO HG2 H 1 2.010 0.03 . 2 . . . . . 178 PRO HG2 . 27744 1 1952 . 1 . 1 181 181 PRO HG3 H 1 2.010 0.03 . 2 . . . . . 178 PRO HG3 . 27744 1 1953 . 1 . 1 181 181 PRO C C 13 176.976 0.30 . 1 . . . . . 178 PRO C . 27744 1 1954 . 1 . 1 181 181 PRO CA C 13 63.306 0.30 . 1 . . . . . 178 PRO CA . 27744 1 1955 . 1 . 1 181 181 PRO CB C 13 32.122 0.30 . 1 . . . . . 178 PRO CB . 27744 1 1956 . 1 . 1 181 181 PRO CD C 13 50.322 0.30 . 1 . . . . . 178 PRO CD . 27744 1 1957 . 1 . 1 181 181 PRO CG C 13 27.547 0.30 . 1 . . . . . 178 PRO CG . 27744 1 1958 . 1 . 1 182 182 LYS H H 1 7.856 0.03 . 1 . . . . . 179 LYS H . 27744 1 1959 . 1 . 1 182 182 LYS HA H 1 4.322 0.03 . 1 . . . . . 179 LYS HA . 27744 1 1960 . 1 . 1 182 182 LYS HB2 H 1 1.784 0.03 . 2 . . . . . 179 LYS HB2 . 27744 1 1961 . 1 . 1 182 182 LYS HB3 H 1 1.784 0.03 . 2 . . . . . 179 LYS HB3 . 27744 1 1962 . 1 . 1 182 182 LYS C C 13 176.360 0.30 . 1 . . . . . 179 LYS C . 27744 1 1963 . 1 . 1 182 182 LYS CA C 13 56.584 0.25 . 1 . . . . . 179 LYS CA . 27744 1 1964 . 1 . 1 182 182 LYS CB C 13 33.330 0.30 . 1 . . . . . 179 LYS CB . 27744 1 1965 . 1 . 1 182 182 LYS N N 15 123.017 0.30 . 1 . . . . . 179 LYS N . 27744 1 1966 . 1 . 1 183 183 LYS H H 1 8.419 0.01 . 1 . . . . . 180 LYS H . 27744 1 1967 . 1 . 1 183 183 LYS HA H 1 4.317 0.03 . 1 . . . . . 180 LYS HA . 27744 1 1968 . 1 . 1 183 183 LYS HB2 H 1 1.792 0.03 . 2 . . . . . 180 LYS HB2 . 27744 1 1969 . 1 . 1 183 183 LYS HB3 H 1 1.792 0.03 . 2 . . . . . 180 LYS HB3 . 27744 1 1970 . 1 . 1 183 183 LYS C C 13 176.247 0.30 . 1 . . . . . 180 LYS C . 27744 1 1971 . 1 . 1 183 183 LYS CA C 13 56.331 0.30 . 1 . . . . . 180 LYS CA . 27744 1 1972 . 1 . 1 183 183 LYS CB C 13 33.102 0.30 . 1 . . . . . 180 LYS CB . 27744 1 1973 . 1 . 1 183 183 LYS CD C 13 29.428 0.30 . 1 . . . . . 180 LYS CB . 27744 1 1974 . 1 . 1 183 183 LYS CG C 13 24.780 0.30 . 1 . . . . . 180 LYS CB . 27744 1 1975 . 1 . 1 183 183 LYS N N 15 123.471 0.30 . 1 . . . . . 180 LYS N . 27744 1 1976 . 1 . 1 184 184 LYS H H 1 8.385 0.01 . 1 . . . . . 181 LYS H . 27744 1 1977 . 1 . 1 184 184 LYS HA H 1 4.249 0.05 . 1 . . . . . 181 LYS HA . 27744 1 1978 . 1 . 1 184 184 LYS HB2 H 1 1.744 0.05 . 2 . . . . . 181 LYS HB2 . 27744 1 1979 . 1 . 1 184 184 LYS HB3 H 1 1.744 0.05 . 2 . . . . . 181 LYS HB3 . 27744 1 1980 . 1 . 1 184 184 LYS CA C 13 56.081 0.30 . 1 . . . . . 181 LYS CA . 27744 1 1981 . 1 . 1 184 184 LYS CB C 13 33.100 0.30 . 1 . . . . . 181 LYS CB . 27744 1 1982 . 1 . 1 184 184 LYS N N 15 123.564 0.30 . 1 . . . . . 181 LYS N . 27744 1 1983 . 1 . 1 185 185 LYS H H 1 8.400 0.01 . 1 . . . . . 182 LYS H . 27744 1 1984 . 1 . 1 185 185 LYS HA H 1 4.237 0.01 . 1 . . . . . 182 LYS HA . 27744 1 1985 . 1 . 1 185 185 LYS HB2 H 1 1.736 0.05 . 2 . . . . . 182 LYS HB2 . 27744 1 1986 . 1 . 1 185 185 LYS HB3 H 1 1.736 0.05 . 2 . . . . . 182 LYS HB3 . 27744 1 1987 . 1 . 1 185 185 LYS C C 13 176.207 0.30 . 1 . . . . . 182 LYS C . 27744 1 1988 . 1 . 1 185 185 LYS CA C 13 56.354 0.30 . 1 . . . . . 182 LYS CA . 27744 1 1989 . 1 . 1 185 185 LYS CB C 13 30.390 0.30 . 1 . . . . . 182 LYS CB . 27744 1 1990 . 1 . 1 185 185 LYS CD C 13 29.076 0.30 . 1 . . . . . 182 LYS CD . 27744 1 1991 . 1 . 1 185 185 LYS CE C 13 42.026 0.30 . 1 . . . . . 182 LYS CE . 27744 1 1992 . 1 . 1 185 185 LYS CG C 13 24.687 0.30 . 1 . . . . . 182 LYS CG . 27744 1 1993 . 1 . 1 185 185 LYS N N 15 122.676 0.30 . 1 . . . . . 182 LYS N . 27744 1 stop_ save_